Wednesday, February 29, 2012

http://ChemLookup.com Compounds




CAS RN: 62232-58-0
CAS Name: N,N-dimethyl-4-[2-(phenylthio)phenoxy]-1-butanamine hydrochloride
OPENEYE Name: N,N-dimethyl-4-(2-phenylsulfanylphenoxy)butan-1-amine hydrochloride
IUPAC Name: N,N-dimethyl-4-(2-phenylsulfanylphenoxy)butan-1-amine hydrochloride
SYSTEMATIC NAME: N,N-dimethyl-4-(2-phenylsulfanylphenoxy)butan-1-amine hydrochloride
MOLECULAR FORMULA: C18H24ClNOS
MOLECULAR WEIGHT: 337.90726
SMILES: CN(C)CCCCOC1=CC=CC=C1SC2=CC=CC=C2.Cl
Structure:

CAS RN: 62209-57-8
CAS Name: N,N-bis[[azidomethyl(nitro)amino]methyl]nitramide
OPENEYE Name: N,N-bis[[azidomethyl(nitro)amino]methyl]nitramide
IUPAC Name: N,N-bis[[azidomethyl(nitro)amino]methyl]nitramide
SYSTEMATIC NAME: N,N-bis[[azidomethyl(nitro)amino]methyl]nitramide
MOLECULAR FORMULA: C4H8N12O6
MOLECULAR WEIGHT: 320.18312
SMILES: C(N=[N+]=[N-])N(CN(CN(CN=[N+]=[N-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]
Structure:

CAS RN: 62209-52-3
CAS Name: potassium nitro(2-pyridinyl)azanide
OPENEYE Name: potassium nitro(2-pyridyl)azanide
IUPAC Name: potassium nitro(pyridin-2-yl)azanide
SYSTEMATIC NAME: potassium nitro(pyridin-2-yl)azanide
MOLECULAR FORMULA: C5H4KN3O2
MOLECULAR WEIGHT: 177.20246
SMILES: C1=CC=NC(=C1)[N-][N+](=O)[O-].[K+]
Structure:

CAS RN: 62209-22-7
CAS Name: 1-[(2S)-1,1-dimethyl-2-pyrrolidin-1-iumyl]-3-[(2R)-1,1-dimethyl-2-pyrrolidin-1-iumyl]-2-propanone diiodide
OPENEYE Name: 1-[(2S)-1,1-dimethylpyrrolidin-1-ium-2-yl]-3-[(2R)-1,1-dimethylpyrrolidin-1-ium-2-yl]propan-2-one diiodide
IUPAC Name: 1-[(2S)-1,1-dimethylpyrrolidin-1-ium-2-yl]-3-[(2R)-1,1-dimethylpyrrolidin-1-ium-2-yl]propan-2-one diiodide
SYSTEMATIC NAME: 1-[(2S)-1,1-dimethylpyrrolidin-1-ium-2-yl]-3-[(2R)-1,1-dimethylpyrrolidin-1-ium-2-yl]propan-2-one diiodide
MOLECULAR FORMULA: C15H30I2N2O
MOLECULAR WEIGHT: 508.22044
SMILES: C[N+]1(CCC[C@@H]1CC(=O)C[C@@H]2CCC[N+]2(C)C)C.[I-].[I-]
Structure:

CAS RN: 62208-86-0
CAS Name: 3-chloro-5-hydroxy-2-phenyl-4-pyrazolo[3,4-d]pyrimidinimine
OPENEYE Name: 3-chloro-5-hydroxy-2-phenyl-pyrazolo[3,4-d]pyrimidin-4-imine
IUPAC Name: 3-chloro-5-hydroxy-2-phenylpyrazolo[3,4-d]pyrimidin-4-imine
SYSTEMATIC NAME: 3-chloranyl-5-oxidanyl-2-phenyl-pyrazolo[3,4-d]pyrimidin-4-imine
MOLECULAR FORMULA: C11H8ClN5O
MOLECULAR WEIGHT: 261.66712
SMILES: C1=CC=C(C=C1)N2C(=C3C(=N)N(C=NC3=N2)O)Cl
Structure:

CAS RN: 62208-85-9
CAS Name: 3-chloro-2-phenyl-4-pyrazolo[3,4-d]pyrimidinamine
OPENEYE Name: 3-chloro-2-phenyl-pyrazolo[3,4-d]pyrimidin-4-amine
IUPAC Name: 3-chloro-2-phenylpyrazolo[3,4-d]pyrimidin-4-amine
SYSTEMATIC NAME: 3-chloranyl-2-phenyl-pyrazolo[3,4-d]pyrimidin-4-amine
MOLECULAR FORMULA: C11H8ClN5
MOLECULAR WEIGHT: 245.66772
SMILES: C1=CC=C(C=C1)N2C(=C3C(=NC=NC3=N2)N)Cl
Structure:

CAS RN: 62208-80-4
CAS Name: 3-chloro-5-oxido-2-phenylpyrazolo[3,4-d]pyrimidin-5-ium
OPENEYE Name: 3-chloro-5-oxido-2-phenyl-pyrazolo[3,4-d]pyrimidin-5-ium
IUPAC Name: 3-chloro-5-oxido-2-phenylpyrazolo[3,4-d]pyrimidin-5-ium
SYSTEMATIC NAME: 3-chloranyl-5-oxidanidyl-2-phenyl-pyrazolo[3,4-d]pyrimidin-5-ium
MOLECULAR FORMULA: C11H7ClN4O
MOLECULAR WEIGHT: 246.65248
SMILES: C1=CC=C(C=C1)N2C(=C3C=[N+](C=NC3=N2)[O-])Cl
Structure:

CAS RN: 62208-79-1
CAS Name: 3-chloro-2-phenylpyrazolo[3,4-d]pyrimidine
OPENEYE Name: 3-chloro-2-phenyl-pyrazolo[3,4-d]pyrimidine
IUPAC Name: 3-chloro-2-phenylpyrazolo[3,4-d]pyrimidine
SYSTEMATIC NAME: 3-chloranyl-2-phenyl-pyrazolo[3,4-d]pyrimidine
MOLECULAR FORMULA: C11H7ClN4
MOLECULAR WEIGHT: 230.65308
SMILES: C1=CC=C(C=C1)N2C(=C3C=NC=NC3=N2)Cl
Structure:

CAS RN: 62208-78-0
CAS Name: N'-(5-chloro-4-formyl-1-phenyl-3-pyrazolyl)-N,N-dimethylmethanimidamide
OPENEYE Name: N'-(5-chloro-4-formyl-1-phenyl-pyrazol-3-yl)-N,N-dimethyl-formamidine
IUPAC Name: N'-(5-chloro-4-formyl-1-phenylpyrazol-3-yl)-N,N-dimethylmethanimidamide
SYSTEMATIC NAME: N'-(5-chloranyl-4-methanoyl-1-phenyl-pyrazol-3-yl)-N,N-dimethyl-methanimidamide
MOLECULAR FORMULA: C13H13ClN4O
MOLECULAR WEIGHT: 276.72152
SMILES: CN(C)C=NC1=NN(C(=C1C=O)Cl)C2=CC=CC=C2
Structure:

CAS RN: 62206-30-8
CAS Name: 8-methyl-10,11-dihydro-9H-pyrimido[1,2-a]perimidine
OPENEYE Name: 8-methyl-10,11-dihydro-9H-pyrimido[1,2-a]perimidine
IUPAC Name: 8-methyl-10,11-dihydro-9H-pyrimido[1,2-a]perimidine
SYSTEMATIC NAME: 8-methyl-10,11-dihydro-9H-pyrimido[1,2-a]perimidine
MOLECULAR FORMULA: C15H15N3
MOLECULAR WEIGHT: 237.2997
SMILES: CN1CCCN2C1=NC3=CC=CC4=C3C2=CC=C4
Structure:

CAS RN: 62206-28-4
CAS Name: N-(2-chlorophenyl)-1-methyl-2-perimidinamine
OPENEYE Name: N-(2-chlorophenyl)-1-methyl-perimidin-2-amine
IUPAC Name: N-(2-chlorophenyl)-1-methylperimidin-2-amine
SYSTEMATIC NAME: N-(2-chlorophenyl)-1-methyl-perimidin-2-amine
MOLECULAR FORMULA: C18H14ClN3
MOLECULAR WEIGHT: 307.77686
SMILES: CN1C2=CC=CC3=C2C(=CC=C3)N=C1NC4=CC=CC=C4Cl
Structure:

CAS RN: 62206-27-3
CAS Name: N-(3,4-dimethoxyphenyl)-1-methyl-2-perimidinamine
OPENEYE Name: N-(3,4-dimethoxyphenyl)-1-methyl-perimidin-2-amine
IUPAC Name: N-(3,4-dimethoxyphenyl)-1-methylperimidin-2-amine
SYSTEMATIC NAME: N-(3,4-dimethoxyphenyl)-1-methyl-perimidin-2-amine
MOLECULAR FORMULA: C20H19N3O2
MOLECULAR WEIGHT: 333.38376
SMILES: CN1C2=CC=CC3=C2C(=CC=C3)N=C1NC4=CC(=C(C=C4)OC)OC
Structure:

CAS RN: 62206-26-2
CAS Name: 1-methyl-N-phenyl-2-perimidinamine
OPENEYE Name: 1-methyl-N-phenyl-perimidin-2-amine
IUPAC Name: 1-methyl-N-phenylperimidin-2-amine
SYSTEMATIC NAME: 1-methyl-N-phenyl-perimidin-2-amine
MOLECULAR FORMULA: C18H15N3
MOLECULAR WEIGHT: 273.3318
SMILES: CN1C2=CC=CC3=C2C(=CC=C3)N=C1NC4=CC=CC=C4
Structure:

CAS RN: 62206-25-1
CAS Name: 1-methyl-N-(phenylmethyl)-2-perimidinamine
OPENEYE Name: N-benzyl-1-methyl-perimidin-2-amine
IUPAC Name: N-benzyl-1-methylperimidin-2-amine
SYSTEMATIC NAME: 1-methyl-N-(phenylmethyl)perimidin-2-amine
MOLECULAR FORMULA: C19H17N3
MOLECULAR WEIGHT: 287.35838
SMILES: CN1C2=CC=CC3=C2C(=CC=C3)N=C1NCC4=CC=CC=C4
Structure:

CAS RN: 62206-24-0
CAS Name: 1-phenyl-2-perimidinamine
OPENEYE Name: 1-phenylperimidin-2-amine
IUPAC Name: 1-phenylperimidin-2-amine
SYSTEMATIC NAME: 1-phenylperimidin-2-amine
MOLECULAR FORMULA: C17H13N3
MOLECULAR WEIGHT: 259.30522
SMILES: C1=CC=C(C=C1)N2C3=CC=CC4=C3C(=CC=C4)N=C2N
Structure:

CAS RN: 62205-86-1
CAS Name: 1-methyl-N-(1-phenylpropan-2-yl)-2-perimidinamine
OPENEYE Name: 1-methyl-N-(1-methyl-2-phenyl-ethyl)perimidin-2-amine
IUPAC Name: 1-methyl-N-(1-phenylpropan-2-yl)perimidin-2-amine
SYSTEMATIC NAME: 1-methyl-N-(1-phenylpropan-2-yl)perimidin-2-amine
MOLECULAR FORMULA: C21H21N3
MOLECULAR WEIGHT: 315.41154
SMILES: CC(CC1=CC=CC=C1)NC2=NC3=CC=CC4=C3C(=CC=C4)N2C
Structure:

CAS RN: 62159-89-1
CAS Name: 7-chloro-5-methoxy-4-nitro-5-phenyl-1,3-dihydro-1,4-benzodiazepin-2-one
OPENEYE Name: 7-chloro-5-methoxy-4-nitro-5-phenyl-1,3-dihydro-1,4-benzodiazepin-2-one
IUPAC Name: 7-chloro-5-methoxy-4-nitro-5-phenyl-1,3-dihydro-1,4-benzodiazepin-2-one
SYSTEMATIC NAME: 7-chloranyl-5-methoxy-4-nitro-5-phenyl-1,3-dihydro-1,4-benzodiazepin-2-one
MOLECULAR FORMULA: C16H14ClN3O4
MOLECULAR WEIGHT: 347.75306
SMILES: COC1(C2=C(C=CC(=C2)Cl)NC(=O)CN1[N+](=O)[O-])C3=CC=CC=C3
Structure:

CAS RN: 62159-86-8
CAS Name: 5-methoxy-4,7-dinitro-5-phenyl-1,3-dihydro-1,4-benzodiazepin-2-one
OPENEYE Name: 5-methoxy-4,7-dinitro-5-phenyl-1,3-dihydro-1,4-benzodiazepin-2-one
IUPAC Name: 5-methoxy-4,7-dinitro-5-phenyl-1,3-dihydro-1,4-benzodiazepin-2-one
SYSTEMATIC NAME: 5-methoxy-4,7-dinitro-5-phenyl-1,3-dihydro-1,4-benzodiazepin-2-one
MOLECULAR FORMULA: C16H14N4O6
MOLECULAR WEIGHT: 358.30556
SMILES: COC1(C2=C(C=CC(=C2)[N+](=O)[O-])NC(=O)CN1[N+](=O)[O-])C3=CC=CC=C3
Structure:

CAS RN: 62154-03-4
CAS Name: N-[(1S,2S)-1,3-dihydroxy-1-(4-nitrophenyl)propan-2-yl]-N'-(4-methylphenyl)sulfonyloxamide
OPENEYE Name: N-[(1S,2S)-2-hydroxy-1-(hydroxymethyl)-2-(4-nitrophenyl)ethyl]-N'-(p-tolylsulfonyl)oxamide
IUPAC Name: N-[(1S,2S)-1,3-dihydroxy-1-(4-nitrophenyl)propan-2-yl]-N'-(4-methylphenyl)sulfonyloxamide
SYSTEMATIC NAME: N'-(4-methylphenyl)sulfonyl-N-[(1S,2S)-1-(4-nitrophenyl)-1,3-bis(oxidanyl)propan-2-yl]ethanediamide
MOLECULAR FORMULA: C18H19N3O8S
MOLECULAR WEIGHT: 437.42376
SMILES: CC1=CC=C(C=C1)S(=O)(=O)NC(=O)C(=O)N[C@@H](CO)[C@H](C2=CC=C(C=C2)[N+](=O)[O-])O
Structure:

http://ChemLookup.com Compounds




CAS RN: 62268-33-1
CAS Name: 2-[(2-chloro-1,1-dioxo-1-benzothiophen-3-yl)-methylamino]ethanol
OPENEYE Name: 2-[(2-chloro-1,1-dioxo-benzothiophen-3-yl)-methyl-amino]ethanol
IUPAC Name: 2-[(2-chloro-1,1-dioxo-1-benzothiophen-3-yl)-methylamino]ethanol
SYSTEMATIC NAME: 2-[[2-chloranyl-1,1-bis(oxidanylidene)-1-benzothiophen-3-yl]-methyl-amino]ethanol
MOLECULAR FORMULA: C11H12ClNO3S
MOLECULAR WEIGHT: 273.73588
SMILES: CN(CCO)C1=C(S(=O)(=O)C2=CC=CC=C21)Cl
Structure:

CAS RN: 62268-31-9
CAS Name: 6-[(2-chloro-1,1-dioxo-1-benzothiophen-3-yl)amino]-1-hexanol
OPENEYE Name: 6-[(2-chloro-1,1-dioxo-benzothiophen-3-yl)amino]hexan-1-ol
IUPAC Name: 6-[(2-chloro-1,1-dioxo-1-benzothiophen-3-yl)amino]hexan-1-ol
SYSTEMATIC NAME: 6-[[2-chloranyl-1,1-bis(oxidanylidene)-1-benzothiophen-3-yl]amino]hexan-1-ol
MOLECULAR FORMULA: C14H18ClNO3S
MOLECULAR WEIGHT: 315.81562
SMILES: C1=CC=C2C(=C1)C(=C(S2(=O)=O)Cl)NCCCCCCO
Structure:

CAS RN: 62268-30-8
CAS Name: 3-[(2-chloro-1,1-dioxo-1-benzothiophen-3-yl)amino]-1-propanol
OPENEYE Name: 3-[(2-chloro-1,1-dioxo-benzothiophen-3-yl)amino]propan-1-ol
IUPAC Name: 3-[(2-chloro-1,1-dioxo-1-benzothiophen-3-yl)amino]propan-1-ol
SYSTEMATIC NAME: 3-[[2-chloranyl-1,1-bis(oxidanylidene)-1-benzothiophen-3-yl]amino]propan-1-ol
MOLECULAR FORMULA: C11H12ClNO3S
MOLECULAR WEIGHT: 273.73588
SMILES: C1=CC=C2C(=C1)C(=C(S2(=O)=O)Cl)NCCCO
Structure:

CAS RN: 62268-29-5
CAS Name: 2-chloro-3-[4-(3-chlorophenyl)-1-piperazinyl]-1-benzothiophene 1,1-dioxide
OPENEYE Name: 2-chloro-3-[4-(3-chlorophenyl)piperazin-1-yl]benzothiophene 1,1-dioxide
IUPAC Name: 2-chloro-3-[4-(3-chlorophenyl)piperazin-1-yl]-1-benzothiophene 1,1-dioxide
SYSTEMATIC NAME: 2-chloranyl-3-[4-(3-chlorophenyl)piperazin-1-yl]-1-benzothiophene 1,1-dioxide
MOLECULAR FORMULA: C18H16Cl2N2O2S
MOLECULAR WEIGHT: 395.30284
SMILES: C1CN(CCN1C2=CC(=CC=C2)Cl)C3=C(S(=O)(=O)C4=CC=CC=C43)Cl
Structure:

CAS RN: 62268-28-4
CAS Name: 2-chloro-3-[4-(2-methoxyphenyl)-1-piperazinyl]-1-benzothiophene 1,1-dioxide
OPENEYE Name: 2-chloro-3-[4-(2-methoxyphenyl)piperazin-1-yl]benzothiophene 1,1-dioxide
IUPAC Name: 2-chloro-3-[4-(2-methoxyphenyl)piperazin-1-yl]-1-benzothiophene 1,1-dioxide
SYSTEMATIC NAME: 2-chloranyl-3-[4-(2-methoxyphenyl)piperazin-1-yl]-1-benzothiophene 1,1-dioxide
MOLECULAR FORMULA: C19H19ClN2O3S
MOLECULAR WEIGHT: 390.88376
SMILES: COC1=CC=CC=C1N2CCN(CC2)C3=C(S(=O)(=O)C4=CC=CC=C43)Cl
Structure:

CAS RN: 62268-27-3
CAS Name: 2-chloro-3-(4-phenyl-1-piperazinyl)-1-benzothiophene 1,1-dioxide
OPENEYE Name: 2-chloro-3-(4-phenylpiperazin-1-yl)benzothiophene 1,1-dioxide
IUPAC Name: 2-chloro-3-(4-phenylpiperazin-1-yl)-1-benzothiophene 1,1-dioxide
SYSTEMATIC NAME: 2-chloranyl-3-(4-phenylpiperazin-1-yl)-1-benzothiophene 1,1-dioxide
MOLECULAR FORMULA: C18H17ClN2O2S
MOLECULAR WEIGHT: 360.85778
SMILES: C1CN(CCN1C2=CC=CC=C2)C3=C(S(=O)(=O)C4=CC=CC=C43)Cl
Structure:

CAS RN: 62268-14-8
CAS Name: 4,5,6-trichloro-7-(methylthio)-3H-isobenzofuran-1-one
OPENEYE Name: 4,5,6-trichloro-7-methylsulfanyl-3H-isobenzofuran-1-one
IUPAC Name: 4,5,6-trichloro-7-methylsulfanyl-3H-2-benzofuran-1-one
SYSTEMATIC NAME: 4,5,6-tris(chloranyl)-7-methylsulfanyl-3H-2-benzofuran-1-one
MOLECULAR FORMULA: C9H5Cl3O2S
MOLECULAR WEIGHT: 283.5588
SMILES: CSC1=C(C(=C(C2=C1C(=O)OC2)Cl)Cl)Cl
Structure:

CAS RN: 62268-12-6
CAS Name: 4,6,7-trichloro-5-(methylthio)-3H-isobenzofuran-1-one
OPENEYE Name: 4,6,7-trichloro-5-methylsulfanyl-3H-isobenzofuran-1-one
IUPAC Name: 4,6,7-trichloro-5-methylsulfanyl-3H-2-benzofuran-1-one
SYSTEMATIC NAME: 4,6,7-tris(chloranyl)-5-methylsulfanyl-3H-2-benzofuran-1-one
MOLECULAR FORMULA: C9H5Cl3O2S
MOLECULAR WEIGHT: 283.5588
SMILES: CSC1=C(C2=C(C(=C1Cl)Cl)C(=O)OC2)Cl
Structure:

CAS RN: 62265-22-9
CAS Name: 1-[4-(4-fluorophenyl)-4-oxobutyl]-4-(1-piperidinyl)-4-piperidinecarboxamide hydrochloride
OPENEYE Name: 1-[4-(4-fluorophenyl)-4-oxo-butyl]-4-(1-piperidyl)piperidine-4-carboxamide hydrochloride
IUPAC Name: 1-[4-(4-fluorophenyl)-4-oxobutyl]-4-piperidin-1-ylpiperidine-4-carboxamide hydrochloride
SYSTEMATIC NAME: 1-[4-(4-fluorophenyl)-4-oxidanylidene-butyl]-4-piperidin-1-yl-piperidine-4-carboxamide hydrochloride
MOLECULAR FORMULA: C21H31ClFN3O2
MOLECULAR WEIGHT: 411.941143
SMILES: C1CCN(CC1)C2(CCN(CC2)CCCC(=O)C3=CC=C(C=C3)F)C(=O)N.Cl
Structure:

CAS RN: 62246-71-3
CAS Name: (diphenylmethyl)oxy-ethoxy-methyl-sulfanylidenephosphorane
OPENEYE Name: benzhydryloxy-ethoxy-methyl-thioxo-$l^{5}-phosphane
IUPAC Name: benzhydryloxy-ethoxy-methyl-sulfanylidene-$l^{5}-phosphane
SYSTEMATIC NAME: (diphenylmethyl)oxy-ethoxy-methyl-sulfanylidene-$l^{5}-phosphane
MOLECULAR FORMULA: C16H19O2PS
MOLECULAR WEIGHT: 306.359621
SMILES: CCOP(=S)(C)OC(C1=CC=CC=C1)C2=CC=CC=C2
Structure:

CAS RN: 62243-35-0
CAS Name: 2-hydroxypropanoic acid; 4-[4-[2-(1-phenylpropan-2-ylamino)ethyl]phenoxy]phenol
OPENEYE Name: 2-hydroxypropanoic acid; 4-[4-[2-[(1-methyl-2-phenyl-ethyl)amino]ethyl]phenoxy]phenol
IUPAC Name: 2-hydroxypropanoic acid; 4-[4-[2-(1-phenylpropan-2-ylamino)ethyl]phenoxy]phenol
SYSTEMATIC NAME: 2-oxidanylpropanoic acid; 4-[4-[2-(1-phenylpropan-2-ylamino)ethyl]phenoxy]phenol
MOLECULAR FORMULA: C26H31NO5
MOLECULAR WEIGHT: 437.52804
SMILES: CC(CC1=CC=CC=C1)NCCC2=CC=C(C=C2)OC3=CC=C(C=C3)O.CC(C(=O)O)O
Structure:

CAS RN: 62243-33-8
CAS Name: 4-[4-[2-(1-phenylpropan-2-ylamino)ethyl]phenoxy]phenol hydrochloride
OPENEYE Name: 4-[4-[2-[(1-methyl-2-phenyl-ethyl)amino]ethyl]phenoxy]phenol hydrochloride
IUPAC Name: 4-[4-[2-(1-phenylpropan-2-ylamino)ethyl]phenoxy]phenol hydrochloride
SYSTEMATIC NAME: 4-[4-[2-(1-phenylpropan-2-ylamino)ethyl]phenoxy]phenol hydrochloride
MOLECULAR FORMULA: C23H26ClNO2
MOLECULAR WEIGHT: 383.91104
SMILES: CC(CC1=CC=CC=C1)NCCC2=CC=C(C=C2)OC3=CC=C(C=C3)O.Cl
Structure:

CAS RN: 62238-68-0
CAS Name: 1-[3-(dimethylamino)propyl]-2-perimidinamine
OPENEYE Name: 1-[3-(dimethylamino)propyl]perimidin-2-amine
IUPAC Name: 1-[3-(dimethylamino)propyl]perimidin-2-amine
SYSTEMATIC NAME: 1-[3-(dimethylamino)propyl]perimidin-2-amine
MOLECULAR FORMULA: C16H20N4
MOLECULAR WEIGHT: 268.3568
SMILES: CN(C)CCCN1C2=CC=CC3=C2C(=CC=C3)N=C1N
Structure:

CAS RN: 62232-79-5
CAS Name: N-methyl-4-(2-phenylphenoxy)-1-butanamine hydrochloride
OPENEYE Name: N-methyl-4-(2-phenylphenoxy)butan-1-amine hydrochloride
IUPAC Name: N-methyl-4-(2-phenylphenoxy)butan-1-amine hydrochloride
SYSTEMATIC NAME: N-methyl-4-(2-phenylphenoxy)butan-1-amine hydrochloride
MOLECULAR FORMULA: C17H22ClNO
MOLECULAR WEIGHT: 291.81568
SMILES: CNCCCCOC1=CC=CC=C1C2=CC=CC=C2.Cl
Structure:

CAS RN: 62232-78-4
CAS Name: 4-(2-phenylphenoxy)-1-butanamine hydrochloride
OPENEYE Name: 4-(2-phenylphenoxy)butan-1-amine hydrochloride
IUPAC Name: 4-(2-phenylphenoxy)butan-1-amine hydrochloride
SYSTEMATIC NAME: 4-(2-phenylphenoxy)butan-1-amine hydrochloride
MOLECULAR FORMULA: C16H20ClNO
MOLECULAR WEIGHT: 277.7891
SMILES: C1=CC=C(C=C1)C2=CC=CC=C2OCCCCN.Cl
Structure:

CAS RN: 62232-61-5
CAS Name: N-methyl-4-[2-(phenylthio)phenoxy]-1-butanamine hydrochloride
OPENEYE Name: N-methyl-4-(2-phenylsulfanylphenoxy)butan-1-amine hydrochloride
IUPAC Name: N-methyl-4-(2-phenylsulfanylphenoxy)butan-1-amine hydrochloride
SYSTEMATIC NAME: N-methyl-4-(2-phenylsulfanylphenoxy)butan-1-amine hydrochloride
MOLECULAR FORMULA: C17H22ClNOS
MOLECULAR WEIGHT: 323.88068
SMILES: CNCCCCOC1=CC=CC=C1SC2=CC=CC=C2.Cl
Structure:

CAS RN: 62232-59-1
CAS Name: N-methyl-3-[2-(phenylthio)phenoxy]-1-propanamine hydrochloride
OPENEYE Name: N-methyl-3-(2-phenylsulfanylphenoxy)propan-1-amine hydrochloride
IUPAC Name: N-methyl-3-(2-phenylsulfanylphenoxy)propan-1-amine hydrochloride
SYSTEMATIC NAME: N-methyl-3-(2-phenylsulfanylphenoxy)propan-1-amine hydrochloride
MOLECULAR FORMULA: C16H20ClNOS
MOLECULAR WEIGHT: 309.8541
SMILES: CNCCCOC1=CC=CC=C1SC2=CC=CC=C2.Cl
Structure:

http://ChemLookup.com Compounds




CAS RN: 62393-18-4
CAS Name: methyl-diphenyl-[2-(1-piperidinyl)ethoxy]silane
OPENEYE Name: methyl-diphenyl-[2-(1-piperidyl)ethoxy]silane
IUPAC Name: methyl-diphenyl-(2-piperidin-1-ylethoxy)silane
SYSTEMATIC NAME: methyl-diphenyl-(2-piperidin-1-ylethoxy)silane
MOLECULAR FORMULA: C20H27NOSi
MOLECULAR WEIGHT: 325.51998
SMILES: C[Si](C1=CC=CC=C1)(C2=CC=CC=C2)OCCN3CCCCC3
Structure:

CAS RN: 62367-92-4
CAS Name: 2-methylene-1-(2-phenyl-1H-indol-3-yl)butane-1,3-dione
OPENEYE Name: 2-methylene-1-(2-phenyl-1H-indol-3-yl)butane-1,3-dione
IUPAC Name: 2-methylidene-1-(2-phenyl-1H-indol-3-yl)butane-1,3-dione
SYSTEMATIC NAME: 2-methylidene-1-(2-phenyl-1H-indol-3-yl)butane-1,3-dione
MOLECULAR FORMULA: C19H15NO2
MOLECULAR WEIGHT: 289.3279
SMILES: CC(=O)C(=C)C(=O)C1=C(NC2=CC=CC=C21)C3=CC=CC=C3
Structure:

CAS RN: 62367-91-3
CAS Name: 3-[oxo-(2-phenyl-1H-indol-3-yl)methyl]heptane-2,6-dione
OPENEYE Name: 3-(2-phenyl-1H-indole-3-carbonyl)heptane-2,6-dione
IUPAC Name: 3-(2-phenyl-1H-indole-3-carbonyl)heptane-2,6-dione
SYSTEMATIC NAME: 3-[(2-phenyl-1H-indol-3-yl)carbonyl]heptane-2,6-dione
MOLECULAR FORMULA: C22H21NO3
MOLECULAR WEIGHT: 347.40704
SMILES: CC(=O)CCC(C(=O)C)C(=O)C1=C(NC2=CC=CC=C21)C3=CC=CC=C3
Structure:

CAS RN: 62367-89-9
CAS Name: 2-ethyl-1-(2-phenyl-1H-indol-3-yl)butane-1,3-dione
OPENEYE Name: 2-ethyl-1-(2-phenyl-1H-indol-3-yl)butane-1,3-dione
IUPAC Name: 2-ethyl-1-(2-phenyl-1H-indol-3-yl)butane-1,3-dione
SYSTEMATIC NAME: 2-ethyl-1-(2-phenyl-1H-indol-3-yl)butane-1,3-dione
MOLECULAR FORMULA: C20H19NO2
MOLECULAR WEIGHT: 305.37036
SMILES: CCC(C(=O)C)C(=O)C1=C(NC2=CC=CC=C21)C3=CC=CC=C3
Structure:

CAS RN: 62367-87-7
CAS Name: 2-bromo-1-(2-phenyl-1H-indol-3-yl)butane-1,3-dione
OPENEYE Name: 2-bromo-1-(2-phenyl-1H-indol-3-yl)butane-1,3-dione
IUPAC Name: 2-bromo-1-(2-phenyl-1H-indol-3-yl)butane-1,3-dione
SYSTEMATIC NAME: 2-bromanyl-1-(2-phenyl-1H-indol-3-yl)butane-1,3-dione
MOLECULAR FORMULA: C18H14BrNO2
MOLECULAR WEIGHT: 356.21326
SMILES: CC(=O)C(C(=O)C1=C(NC2=CC=CC=C21)C3=CC=CC=C3)Br
Structure:

CAS RN: 62367-85-5
CAS Name: 1-(4-chlorophenyl)-3-(2-phenyl-1H-indol-3-yl)propane-1,3-dione
OPENEYE Name: 1-(4-chlorophenyl)-3-(2-phenyl-1H-indol-3-yl)propane-1,3-dione
IUPAC Name: 1-(4-chlorophenyl)-3-(2-phenyl-1H-indol-3-yl)propane-1,3-dione
SYSTEMATIC NAME: 1-(4-chlorophenyl)-3-(2-phenyl-1H-indol-3-yl)propane-1,3-dione
MOLECULAR FORMULA: C23H16ClNO2
MOLECULAR WEIGHT: 373.83164
SMILES: C1=CC=C(C=C1)C2=C(C3=CC=CC=C3N2)C(=O)CC(=O)C4=CC=C(C=C4)Cl
Structure:

CAS RN: 62367-84-4
CAS Name: 1-phenyl-3-(2-phenyl-1H-indol-3-yl)propane-1,3-dione
OPENEYE Name: 1-phenyl-3-(2-phenyl-1H-indol-3-yl)propane-1,3-dione
IUPAC Name: 1-phenyl-3-(2-phenyl-1H-indol-3-yl)propane-1,3-dione
SYSTEMATIC NAME: 1-phenyl-3-(2-phenyl-1H-indol-3-yl)propane-1,3-dione
MOLECULAR FORMULA: C23H17NO2
MOLECULAR WEIGHT: 339.38658
SMILES: C1=CC=C(C=C1)C2=C(C3=CC=CC=C3N2)C(=O)CC(=O)C4=CC=CC=C4
Structure:

CAS RN: 62367-80-0
CAS Name: 1-(4-chlorophenyl)-3-(1-methyl-2-phenyl-3-indolyl)propane-1,3-dione
OPENEYE Name: 1-(4-chlorophenyl)-3-(1-methyl-2-phenyl-indol-3-yl)propane-1,3-dione
IUPAC Name: 1-(4-chlorophenyl)-3-(1-methyl-2-phenylindol-3-yl)propane-1,3-dione
SYSTEMATIC NAME: 1-(4-chlorophenyl)-3-(1-methyl-2-phenyl-indol-3-yl)propane-1,3-dione
MOLECULAR FORMULA: C24H18ClNO2
MOLECULAR WEIGHT: 387.85822
SMILES: CN1C2=CC=CC=C2C(=C1C3=CC=CC=C3)C(=O)CC(=O)C4=CC=C(C=C4)Cl
Structure:

CAS RN: 62367-78-6
CAS Name: 1-phenyl-3-[2-phenyl-1-(phenylmethyl)-3-indolyl]propane-1,3-dione
OPENEYE Name: 1-(1-benzyl-2-phenyl-indol-3-yl)-3-phenyl-propane-1,3-dione
IUPAC Name: 1-(1-benzyl-2-phenylindol-3-yl)-3-phenylpropane-1,3-dione
SYSTEMATIC NAME: 1-phenyl-3-[2-phenyl-1-(phenylmethyl)indol-3-yl]propane-1,3-dione
MOLECULAR FORMULA: C30H23NO2
MOLECULAR WEIGHT: 429.50912
SMILES: C1=CC=C(C=C1)CN2C3=CC=CC=C3C(=C2C4=CC=CC=C4)C(=O)CC(=O)C5=CC=CC=C5
Structure:

CAS RN: 62367-77-5
CAS Name: 1-(1-methyl-2-phenyl-3-indolyl)-3-phenylpropane-1,3-dione
OPENEYE Name: 1-(1-methyl-2-phenyl-indol-3-yl)-3-phenyl-propane-1,3-dione
IUPAC Name: 1-(1-methyl-2-phenylindol-3-yl)-3-phenylpropane-1,3-dione
SYSTEMATIC NAME: 1-(1-methyl-2-phenyl-indol-3-yl)-3-phenyl-propane-1,3-dione
MOLECULAR FORMULA: C24H19NO2
MOLECULAR WEIGHT: 353.41316
SMILES: CN1C2=CC=CC=C2C(=C1C3=CC=CC=C3)C(=O)CC(=O)C4=CC=CC=C4
Structure:

CAS RN: 62367-76-4
CAS Name: 1-(1-methyl-2-phenyl-3-indolyl)-4-(1-piperidinyl)butane-1,3-dione
OPENEYE Name: 1-(1-methyl-2-phenyl-indol-3-yl)-4-(1-piperidyl)butane-1,3-dione
IUPAC Name: 1-(1-methyl-2-phenylindol-3-yl)-4-piperidin-1-ylbutane-1,3-dione
SYSTEMATIC NAME: 1-(1-methyl-2-phenyl-indol-3-yl)-4-piperidin-1-yl-butane-1,3-dione
MOLECULAR FORMULA: C24H26N2O2
MOLECULAR WEIGHT: 374.47544
SMILES: CN1C2=CC=CC=C2C(=C1C3=CC=CC=C3)C(=O)CC(=O)CN4CCCCC4
Structure:

CAS RN: 62367-73-1
CAS Name: 1-(1-methyl-2-phenyl-3-indolyl)-4-propylheptane-1,3-dione
OPENEYE Name: 1-(1-methyl-2-phenyl-indol-3-yl)-4-propyl-heptane-1,3-dione
IUPAC Name: 1-(1-methyl-2-phenylindol-3-yl)-4-propylheptane-1,3-dione
SYSTEMATIC NAME: 1-(1-methyl-2-phenyl-indol-3-yl)-4-propyl-heptane-1,3-dione
MOLECULAR FORMULA: C25H29NO2
MOLECULAR WEIGHT: 375.50326
SMILES: CCCC(CCC)C(=O)CC(=O)C1=C(N(C2=CC=CC=C21)C)C3=CC=CC=C3
Structure:

CAS RN: 62367-72-0
CAS Name: 1-(2-cyclohexyl-1H-indol-3-yl)butane-1,3-dione
OPENEYE Name: 1-(2-cyclohexyl-1H-indol-3-yl)butane-1,3-dione
IUPAC Name: 1-(2-cyclohexyl-1H-indol-3-yl)butane-1,3-dione
SYSTEMATIC NAME: 1-(2-cyclohexyl-1H-indol-3-yl)butane-1,3-dione
MOLECULAR FORMULA: C18H21NO2
MOLECULAR WEIGHT: 283.36484
SMILES: CC(=O)CC(=O)C1=C(NC2=CC=CC=C21)C3CCCCC3
Structure:

CAS RN: 62367-70-8
CAS Name: 1-(2-cyclopropyl-1H-indol-3-yl)butane-1,3-dione
OPENEYE Name: 1-(2-cyclopropyl-1H-indol-3-yl)butane-1,3-dione
IUPAC Name: 1-(2-cyclopropyl-1H-indol-3-yl)butane-1,3-dione
SYSTEMATIC NAME: 1-(2-cyclopropyl-1H-indol-3-yl)butane-1,3-dione
MOLECULAR FORMULA: C15H15NO2
MOLECULAR WEIGHT: 241.2851
SMILES: CC(=O)CC(=O)C1=C(NC2=CC=CC=C21)C3CC3
Structure:

CAS RN: 62356-28-9
CAS Name: 1,2-diphenylpyrrolo[3,2-b]quinoxaline
OPENEYE Name: 1,2-diphenylpyrrolo[3,2-b]quinoxaline
IUPAC Name: 1,2-diphenylpyrrolo[3,2-b]quinoxaline
SYSTEMATIC NAME: 1,2-diphenylpyrrolo[3,2-b]quinoxaline
MOLECULAR FORMULA: C22H15N3
MOLECULAR WEIGHT: 321.3746
SMILES: C1=CC=C(C=C1)C2=CC3=NC4=CC=CC=C4N=C3N2C5=CC=CC=C5
Structure:

CAS RN: 62355-45-7
CAS Name: N,N'-dimethylcarbamimidothioic acid [3-(2-chlorophenyl)-4-oxo-2-quinazolinyl]methyl ester hydrobromide
OPENEYE Name: 2-[[3-(2-chlorophenyl)-4-oxo-quinazolin-2-yl]methyl]-1,3-dimethyl-isothiourea hydrobromide
IUPAC Name: [3-(2-chlorophenyl)-4-oxoquinazolin-2-yl]methyl N,N'-dimethylcarbamimidothioate hydrobromide
SYSTEMATIC NAME: [3-(2-chlorophenyl)-4-oxidanylidene-quinazolin-2-yl]methyl N,N'-dimethylcarbamimidothioate hydrobromide
MOLECULAR FORMULA: C18H18BrClN4OS
MOLECULAR WEIGHT: 453.78372
SMILES: CNC(=NC)SCC1=NC2=CC=CC=C2C(=O)N1C3=CC=CC=C3Cl.Br
Structure:

CAS RN: 62355-03-7
CAS Name: benzenesulfonate; 1,3-bis(1,1-dimethyl-2-pyrrolidin-1-iumyl)-2-propanone
OPENEYE Name: benzenesulfonate; 1,3-bis(1,1-dimethylpyrrolidin-1-ium-2-yl)propan-2-one
IUPAC Name: benzenesulfonate; 1,3-bis(1,1-dimethylpyrrolidin-1-ium-2-yl)propan-2-one
SYSTEMATIC NAME: benzenesulfonate; 1,3-bis(1,1-dimethylpyrrolidin-1-ium-2-yl)propan-2-one
MOLECULAR FORMULA: C27H40N2O7S2
MOLECULAR WEIGHT: 568.7457
SMILES: C[N+]1(CCCC1CC(=O)CC2CCC[N+]2(C)C)C.C1=CC=C(C=C1)S(=O)(=O)[O-].C1=CC=C(C=C1)S(=O)(=O)[O-]
Structure:

CAS RN: 62350-31-6
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C30H36O8
MOLECULAR WEIGHT: 524.60204
SMILES: CC1CC2(C(C2(C)C)C3C1(C4C=C(C(=O)C4(CC(=C3)COC(=O)C)O)C)O)OC(=O)CC5=CC=C(C=C5)O
Structure:

CAS RN: 62349-04-6
CAS Name: 2-[[1-(3,6-dihydro-2H-pyridin-1-yl)-1-hydroxyethyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid ethyl ester
OPENEYE Name: ethyl 2-[[1-(3,6-dihydro-2H-pyridin-1-yl)-1-hydroxy-ethyl]amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate
IUPAC Name: ethyl 2-[[1-(3,6-dihydro-2H-pyridin-1-yl)-1-hydroxyethyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
SYSTEMATIC NAME: ethyl 2-[[1-(3,6-dihydro-2H-pyridin-1-yl)-1-oxidanyl-ethyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
MOLECULAR FORMULA: C18H26N2O3S
MOLECULAR WEIGHT: 350.47564
SMILES: CCOC(=O)C1=C(SC2=C1CCCC2)NC(C)(N3CCC=CC3)O
Structure:

CAS RN: 62314-48-1
CAS Name: 2-(1,3-dithiepan-2-ylidene)propanedioic acid dipropan-2-yl ester
OPENEYE Name: diisopropyl 2-(1,3-dithiepan-2-ylidene)propanedioate
IUPAC Name: dipropan-2-yl 2-(1,3-dithiepan-2-ylidene)propanedioate
SYSTEMATIC NAME: dipropan-2-yl 2-(1,3-dithiepan-2-ylidene)propanedioate
MOLECULAR FORMULA: C14H22O4S2
MOLECULAR WEIGHT: 318.45208
SMILES: CC(C)OC(=O)C(=C1SCCCCS1)C(=O)OC(C)C
Structure:

CAS RN: 62287-32-5
CAS Name: ammonium 4-[[2-[1,3-dioxo-1,3-di(propan-2-yloxy)propan-2-ylidene]-1,3-dithiolan-4-yl]oxy]-4-oxobutanoate
OPENEYE Name: ammonium 4-[[2-(2-isopropoxy-1-isopropoxycarbonyl-2-oxo-ethylidene)-1,3-dithiolan-4-yl]oxy]-4-oxo-butanoate
IUPAC Name: azanium 4-[[2-[1,3-dioxo-1,3-di(propan-2-yloxy)propan-2-ylidene]-1,3-dithiolan-4-yl]oxy]-4-oxobutanoate
SYSTEMATIC NAME: azanium 4-[[2-[1,3-bis(oxidanylidene)-1,3-di(propan-2-yloxy)propan-2-ylidene]-1,3-dithiolan-4-yl]oxy]-4-oxidanylidene-butanoate
MOLECULAR FORMULA: C16H25NO8S2
MOLECULAR WEIGHT: 423.5016
SMILES: CC(C)OC(=O)C(=C1SCC(S1)OC(=O)CCC(=O)[O-])C(=O)OC(C)C.[NH4+]
Structure:

CAS RN: 62270-80-8
CAS Name: 1-[4-(3-chlorophenyl)-1-[3-(4-morpholinyl)propyl]-4-piperidinyl]-1-pentanone dihydrochloride
OPENEYE Name: 1-[4-(3-chlorophenyl)-1-(3-morpholinopropyl)-4-piperidyl]pentan-1-one dihydrochloride
IUPAC Name: 1-[4-(3-chlorophenyl)-1-(3-morpholin-4-ylpropyl)piperidin-4-yl]pentan-1-one dihydrochloride
SYSTEMATIC NAME: 1-[4-(3-chlorophenyl)-1-(3-morpholin-4-ylpropyl)piperidin-4-yl]pentan-1-one dihydrochloride
MOLECULAR FORMULA: C23H37Cl3N2O2
MOLECULAR WEIGHT: 479.91108
SMILES: CCCCC(=O)C1(CCN(CC1)CCCN2CCOCC2)C3=CC(=CC=C3)Cl.Cl.Cl
Structure:

CAS RN: 62270-78-4
CAS Name: 1-[4-(3-chlorophenyl)-1-[3-(4-morpholinyl)propyl]-4-piperidinyl]-1-propanone dihydrochloride
OPENEYE Name: 1-[4-(3-chlorophenyl)-1-(3-morpholinopropyl)-4-piperidyl]propan-1-one dihydrochloride
IUPAC Name: 1-[4-(3-chlorophenyl)-1-(3-morpholin-4-ylpropyl)piperidin-4-yl]propan-1-one dihydrochloride
SYSTEMATIC NAME: 1-[4-(3-chlorophenyl)-1-(3-morpholin-4-ylpropyl)piperidin-4-yl]propan-1-one dihydrochloride
MOLECULAR FORMULA: C21H33Cl3N2O2
MOLECULAR WEIGHT: 451.85792
SMILES: CCC(=O)C1(CCN(CC1)CCCN2CCOCC2)C3=CC(=CC=C3)Cl.Cl.Cl
Structure:

CAS RN: 62270-76-2
CAS Name: 1-[4-(3-chlorophenyl)-1-[3-(1-piperidinyl)propyl]-4-piperidinyl]-1-pentanone dihydrochloride
OPENEYE Name: 1-[4-(3-chlorophenyl)-1-[3-(1-piperidyl)propyl]-4-piperidyl]pentan-1-one dihydrochloride
IUPAC Name: 1-[4-(3-chlorophenyl)-1-(3-piperidin-1-ylpropyl)piperidin-4-yl]pentan-1-one dihydrochloride
SYSTEMATIC NAME: 1-[4-(3-chlorophenyl)-1-(3-piperidin-1-ylpropyl)piperidin-4-yl]pentan-1-one dihydrochloride
MOLECULAR FORMULA: C24H39Cl3N2O
MOLECULAR WEIGHT: 477.93826
SMILES: CCCCC(=O)C1(CCN(CC1)CCCN2CCCCC2)C3=CC(=CC=C3)Cl.Cl.Cl
Structure:

CAS RN: 62270-74-0
CAS Name: 1-[4-(3-chlorophenyl)-1-[3-(1-piperidinyl)propyl]-4-piperidinyl]-1-propanone dihydrochloride
OPENEYE Name: 1-[4-(3-chlorophenyl)-1-[3-(1-piperidyl)propyl]-4-piperidyl]propan-1-one dihydrochloride
IUPAC Name: 1-[4-(3-chlorophenyl)-1-(3-piperidin-1-ylpropyl)piperidin-4-yl]propan-1-one dihydrochloride
SYSTEMATIC NAME: 1-[4-(3-chlorophenyl)-1-(3-piperidin-1-ylpropyl)piperidin-4-yl]propan-1-one dihydrochloride
MOLECULAR FORMULA: C22H35Cl3N2O
MOLECULAR WEIGHT: 449.8851
SMILES: CCC(=O)C1(CCN(CC1)CCCN2CCCCC2)C3=CC(=CC=C3)Cl.Cl.Cl
Structure: