Sunday, September 30, 2012

http://ChemLookup.com Compounds




CAS RN: 2730-27-0
CAS Name: 1-(4-fluorophenyl)-3-(4-morpholinyl)-1-propanone hydrochloride
OPENEYE Name: 1-(4-fluorophenyl)-3-morpholino-propan-1-one hydrochloride
IUPAC Name: 1-(4-fluorophenyl)-3-morpholin-4-ylpropan-1-one hydrochloride
SYSTEMATIC NAME: 1-(4-fluorophenyl)-3-morpholin-4-yl-propan-1-one hydrochloride
MOLECULAR FORMULA: C13H17ClFNO2
MOLECULAR WEIGHT: 273.730983
SMILES: C1COCCN1CCC(=O)C2=CC=C(C=C2)F.Cl
Structure:

CAS RN: 2729-03-5
CAS Name: 4-[3-[(4-fluorophenyl)-phenylmethoxy]propyl]morpholine hydrochloride
OPENEYE Name: 4-[3-[(4-fluorophenyl)-phenyl-methoxy]propyl]morpholine hydrochloride
IUPAC Name: 4-[3-[(4-fluorophenyl)-phenylmethoxy]propyl]morpholine hydrochloride
SYSTEMATIC NAME: 4-[3-[(4-fluorophenyl)-phenyl-methoxy]propyl]morpholine hydrochloride
MOLECULAR FORMULA: C20H25ClFNO2
MOLECULAR WEIGHT: 365.869403
SMILES: C1COCCN1CCCOC(C2=CC=CC=C2)C3=CC=C(C=C3)F.Cl
Structure:

CAS RN: 2728-78-1
CAS Name: N2-(2-phenylethyl)-6-(trifluoromethyl)-1,3,5-triazine-2,4-diamine
OPENEYE Name: N2-(2-phenylethyl)-6-(trifluoromethyl)-1,3,5-triazine-2,4-diamine
IUPAC Name: 2-N-(2-phenylethyl)-6-(trifluoromethyl)-1,3,5-triazine-2,4-diamine
SYSTEMATIC NAME: N2-(2-phenylethyl)-6-(trifluoromethyl)-1,3,5-triazine-2,4-diamine
MOLECULAR FORMULA: C12H12F3N5
MOLECULAR WEIGHT: 283.25239
SMILES: C1=CC=C(C=C1)CCNC2=NC(=NC(=N2)N)C(F)(F)F
Structure:

CAS RN: 2727-97-1
CAS Name: 4-methyl-6-phenyl-2-[2-(1-piperidinyl)ethyl]-3-pyridazinone hydrochloride
OPENEYE Name: 4-methyl-6-phenyl-2-[2-(1-piperidyl)ethyl]pyridazin-3-one hydrochloride
IUPAC Name: 4-methyl-6-phenyl-2-(2-piperidin-1-ylethyl)pyridazin-3-one hydrochloride
SYSTEMATIC NAME: 4-methyl-6-phenyl-2-(2-piperidin-1-ylethyl)pyridazin-3-one hydrochloride
MOLECULAR FORMULA: C18H24ClN3O
MOLECULAR WEIGHT: 333.85566
SMILES: CC1=CC(=NN(C1=O)CCN2CCCCC2)C3=CC=CC=C3.Cl
Structure:

CAS RN: 2727-96-0
CAS Name: 2-[2-(dimethylamino)ethyl]-4-methyl-6-phenyl-3-pyridazinone hydrochloride
OPENEYE Name: 2-[2-(dimethylamino)ethyl]-4-methyl-6-phenyl-pyridazin-3-one hydrochloride
IUPAC Name: 2-[2-(dimethylamino)ethyl]-4-methyl-6-phenylpyridazin-3-one hydrochloride
SYSTEMATIC NAME: 2-[2-(dimethylamino)ethyl]-4-methyl-6-phenyl-pyridazin-3-one hydrochloride
MOLECULAR FORMULA: C15H20ClN3O
MOLECULAR WEIGHT: 293.7918
SMILES: CC1=CC(=NN(C1=O)CCN(C)C)C2=CC=CC=C2.Cl
Structure:

CAS RN: 2727-94-8
CAS Name: 4-methyl-2-[2-(4-morpholinyl)ethyl]-6-phenyl-3-pyridazinone hydrochloride
OPENEYE Name: 4-methyl-2-(2-morpholinoethyl)-6-phenyl-pyridazin-3-one hydrochloride
IUPAC Name: 4-methyl-2-(2-morpholin-4-ylethyl)-6-phenylpyridazin-3-one hydrochloride
SYSTEMATIC NAME: 4-methyl-2-(2-morpholin-4-ylethyl)-6-phenyl-pyridazin-3-one hydrochloride
MOLECULAR FORMULA: C17H22ClN3O2
MOLECULAR WEIGHT: 335.82848
SMILES: CC1=CC(=NN(C1=O)CCN2CCOCC2)C3=CC=CC=C3.Cl
Structure:

CAS RN: 2725-15-7
CAS Name: 1-[4-(4-methoxyphenyl)-1-piperazinyl]-3-phenoxy-2-propanol
OPENEYE Name: 1-[4-(4-methoxyphenyl)piperazin-1-yl]-3-phenoxy-propan-2-ol
IUPAC Name: 1-[4-(4-methoxyphenyl)piperazin-1-yl]-3-phenoxypropan-2-ol
SYSTEMATIC NAME: 1-[4-(4-methoxyphenyl)piperazin-1-yl]-3-phenoxy-propan-2-ol
MOLECULAR FORMULA: C20H26N2O3
MOLECULAR WEIGHT: 342.43204
SMILES: COC1=CC=C(C=C1)N2CCN(CC2)CC(COC3=CC=CC=C3)O
Structure:

CAS RN: 2722-66-9
CAS Name: 2,6-dimethyl-3-(2-methylphenyl)-4-pyrimidinone
OPENEYE Name: 2,6-dimethyl-3-(o-tolyl)pyrimidin-4-one
IUPAC Name: 2,6-dimethyl-3-(2-methylphenyl)pyrimidin-4-one
SYSTEMATIC NAME: 2,6-dimethyl-3-(2-methylphenyl)pyrimidin-4-one
MOLECULAR FORMULA: C13H14N2O
MOLECULAR WEIGHT: 214.26306
SMILES: CC1=CC=CC=C1N2C(=NC(=CC2=O)C)C
Structure:

CAS RN: 2722-34-1
CAS Name: 2-phenyl-4,5-dihydrothiazole
OPENEYE Name: 2-phenyl-4,5-dihydrothiazole
IUPAC Name: 2-phenyl-4,5-dihydro-1,3-thiazole
SYSTEMATIC NAME: 2-phenyl-4,5-dihydro-1,3-thiazole
MOLECULAR FORMULA: C9H9NS
MOLECULAR WEIGHT: 163.23946
SMILES: C1CSC(=N1)C2=CC=CC=C2
Structure:

CAS RN: 2718-09-4
CAS Name: 5-ethyl-3-methyl-5-phenyl-1-prop-2-ynylimidazolidine-2,4-dione
OPENEYE Name: 5-ethyl-3-methyl-5-phenyl-1-prop-2-ynyl-imidazolidine-2,4-dione
IUPAC Name: 5-ethyl-3-methyl-5-phenyl-1-prop-2-ynylimidazolidine-2,4-dione
SYSTEMATIC NAME: 5-ethyl-3-methyl-5-phenyl-1-prop-2-ynyl-imidazolidine-2,4-dione
MOLECULAR FORMULA: C15H16N2O2
MOLECULAR WEIGHT: 256.29974
SMILES: CCC1(C(=O)N(C(=O)N1CC#C)C)C2=CC=CC=C2
Structure:

CAS RN: 2718-07-2
CAS Name: 5,5-diphenyl-3-prop-2-ynylimidazolidine-2,4-dione
OPENEYE Name: 5,5-diphenyl-3-prop-2-ynyl-imidazolidine-2,4-dione
IUPAC Name: 5,5-diphenyl-3-prop-2-ynylimidazolidine-2,4-dione
SYSTEMATIC NAME: 5,5-diphenyl-3-prop-2-ynyl-imidazolidine-2,4-dione
MOLECULAR FORMULA: C18H14N2O2
MOLECULAR WEIGHT: 290.31596
SMILES: C#CCN1C(=O)C(NC1=O)(C2=CC=CC=C2)C3=CC=CC=C3
Structure:

CAS RN: 2716-81-6
CAS Name: N-[bis(1-aziridinyl)phosphoryl]-6-chloro-2-methoxy-4-pyrimidinamine
OPENEYE Name: N-[bis(aziridin-1-yl)phosphoryl]-6-chloro-2-methoxy-pyrimidin-4-amine
IUPAC Name: N-[bis(aziridin-1-yl)phosphoryl]-6-chloro-2-methoxypyrimidin-4-amine
SYSTEMATIC NAME: N-[bis(aziridin-1-yl)phosphoryl]-6-chloranyl-2-methoxy-pyrimidin-4-amine
MOLECULAR FORMULA: C9H13ClN5O2P
MOLECULAR WEIGHT: 289.658581
SMILES: COC1=NC(=CC(=N1)Cl)NP(=O)(N2CC2)N3CC3
Structure:

CAS RN: 2716-79-2
CAS Name: N-[bis(1-aziridinyl)phosphoryl]-2,6-dimethoxy-4-pyrimidinamine
OPENEYE Name: N-[bis(aziridin-1-yl)phosphoryl]-2,6-dimethoxy-pyrimidin-4-amine
IUPAC Name: N-[bis(aziridin-1-yl)phosphoryl]-2,6-dimethoxypyrimidin-4-amine
SYSTEMATIC NAME: N-[bis(aziridin-1-yl)phosphoryl]-2,6-dimethoxy-pyrimidin-4-amine
MOLECULAR FORMULA: C10H16N5O3P
MOLECULAR WEIGHT: 285.239501
SMILES: COC1=NC(=NC(=C1)NP(=O)(N2CC2)N3CC3)OC
Structure:

CAS RN: 2716-78-1
CAS Name: N-[bis(1-aziridinyl)phosphoryl]-5-bromo-6-methyl-4-pyrimidinamine
OPENEYE Name: N-[bis(aziridin-1-yl)phosphoryl]-5-bromo-6-methyl-pyrimidin-4-amine
IUPAC Name: N-[bis(aziridin-1-yl)phosphoryl]-5-bromo-6-methylpyrimidin-4-amine
SYSTEMATIC NAME: N-[bis(aziridin-1-yl)phosphoryl]-5-bromanyl-6-methyl-pyrimidin-4-amine
MOLECULAR FORMULA: C9H13BrN5OP
MOLECULAR WEIGHT: 318.110181
SMILES: CC1=C(C(=NC=N1)NP(=O)(N2CC2)N3CC3)Br
Structure:

CAS RN: 2702-79-6
CAS Name: 2-[(4-chlorophenyl)methyl]-1-cyclohexanone
OPENEYE Name: 2-[(4-chlorophenyl)methyl]cyclohexanone
IUPAC Name: 2-[(4-chlorophenyl)methyl]cyclohexan-1-one
SYSTEMATIC NAME: 2-[(4-chlorophenyl)methyl]cyclohexan-1-one
MOLECULAR FORMULA: C13H15ClO
MOLECULAR WEIGHT: 222.7106
SMILES: C1CCC(=O)C(C1)CC2=CC=C(C=C2)Cl
Structure:

CAS RN: 2700-13-2
CAS Name: 3-[1-[(2-chlorophenyl)methyl]-2-oxocyclopentyl]propanoic acid
OPENEYE Name: 3-[1-[(2-chlorophenyl)methyl]-2-oxo-cyclopentyl]propanoic acid
IUPAC Name: 3-[1-[(2-chlorophenyl)methyl]-2-oxocyclopentyl]propanoic acid
SYSTEMATIC NAME: 3-[1-[(2-chlorophenyl)methyl]-2-oxidanylidene-cyclopentyl]propanoic acid
MOLECULAR FORMULA: C15H17ClO3
MOLECULAR WEIGHT: 280.74668
SMILES: C1CC(=O)C(C1)(CCC(=O)O)CC2=CC=CC=C2Cl
Structure:

CAS RN: 2700-04-1
CAS Name: 3-[1-[(2-methoxyphenyl)methyl]-2-oxocyclopentyl]propanoic acid
OPENEYE Name: 3-[1-[(2-methoxyphenyl)methyl]-2-oxo-cyclopentyl]propanoic acid
IUPAC Name: 3-[1-[(2-methoxyphenyl)methyl]-2-oxocyclopentyl]propanoic acid
SYSTEMATIC NAME: 3-[1-[(2-methoxyphenyl)methyl]-2-oxidanylidene-cyclopentyl]propanoic acid
MOLECULAR FORMULA: C16H20O4
MOLECULAR WEIGHT: 276.3276
SMILES: COC1=CC=CC=C1CC2(CCCC2=O)CCC(=O)O
Structure:

CAS RN: 2700-03-0
CAS Name: 3-[1-[(4-chlorophenyl)methyl]-2-oxocyclopentyl]propanoic acid
OPENEYE Name: 3-[1-[(4-chlorophenyl)methyl]-2-oxo-cyclopentyl]propanoic acid
IUPAC Name: 3-[1-[(4-chlorophenyl)methyl]-2-oxocyclopentyl]propanoic acid
SYSTEMATIC NAME: 3-[1-[(4-chlorophenyl)methyl]-2-oxidanylidene-cyclopentyl]propanoic acid
MOLECULAR FORMULA: C15H17ClO3
MOLECULAR WEIGHT: 280.74668
SMILES: C1CC(=O)C(C1)(CCC(=O)O)CC2=CC=C(C=C2)Cl
Structure:

CAS RN: 2700-01-8
CAS Name: 3-[1-(2-methoxyphenyl)-2-oxocyclopentyl]propanoic acid
OPENEYE Name: 3-[1-(2-methoxyphenyl)-2-oxo-cyclopentyl]propanoic acid
IUPAC Name: 3-[1-(2-methoxyphenyl)-2-oxocyclopentyl]propanoic acid
SYSTEMATIC NAME: 3-[1-(2-methoxyphenyl)-2-oxidanylidene-cyclopentyl]propanoic acid
MOLECULAR FORMULA: C15H18O4
MOLECULAR WEIGHT: 262.30102
SMILES: COC1=CC=CC=C1C2(CCCC2=O)CCC(=O)O
Structure:

CAS RN: 2698-27-3
CAS Name: 2-hydroxy-2,2-diphenylacetic acid (8-ethyl-8-methyl-8-azoniabicyclo[3.2.1]octan-3-yl) ester bromide
OPENEYE Name: (8-ethyl-8-methyl-8-azoniabicyclo[3.2.1]octan-3-yl) 2-hydroxy-2,2-diphenyl-acetate bromide
IUPAC Name: (8-ethyl-8-methyl-8-azoniabicyclo[3.2.1]octan-3-yl) 2-hydroxy-2,2-diphenylacetate bromide
SYSTEMATIC NAME: (8-ethyl-8-methyl-8-azoniabicyclo[3.2.1]octan-3-yl) 2-oxidanyl-2,2-diphenyl-ethanoate bromide
MOLECULAR FORMULA: C24H30BrNO3
MOLECULAR WEIGHT: 460.4039
SMILES: CC[N+]1(C2CCC1CC(C2)OC(=O)C(C3=CC=CC=C3)(C4=CC=CC=C4)O)C.[Br-]
Structure:

CAS RN: 2697-60-1
CAS Name: 1-amino-2-(sulfoseleno)ethane
OPENEYE Name: 1-amino-2-sulfoselanyl-ethane
IUPAC Name: 1-amino-2-sulfoselanylethane
SYSTEMATIC NAME: 1-azanyl-2-sulfoselanyl-ethane
MOLECULAR FORMULA: C2H7NO3SSe
MOLECULAR WEIGHT: 204.10688
SMILES: C(C[Se]S(=O)(=O)O)N
Structure:

CAS RN: 2694-32-8
CAS Name: 1-(4-methoxyphenyl)-3,3a-dihydropyrrolo[3,2-b][1,4]benzothiazin-2-one
OPENEYE Name: 1-(4-methoxyphenyl)-3,3a-dihydropyrrolo[3,2-b][1,4]benzothiazin-2-one
IUPAC Name: 1-(4-methoxyphenyl)-3,3a-dihydropyrrolo[3,2-b][1,4]benzothiazin-2-one
SYSTEMATIC NAME: 1-(4-methoxyphenyl)-3,3a-dihydropyrrolo[3,2-b][1,4]benzothiazin-2-one
MOLECULAR FORMULA: C17H14N2O2S
MOLECULAR WEIGHT: 310.37026
SMILES: COC1=CC=C(C=C1)N2C(=O)CC3C2=NC4=CC=CC=C4S3
Structure:

CAS RN: 2694-31-7
CAS Name: 1-phenyl-3,3a-dihydropyrrolo[3,2-b][1,4]benzothiazin-2-one
OPENEYE Name: 1-phenyl-3,3a-dihydropyrrolo[3,2-b][1,4]benzothiazin-2-one
IUPAC Name: 1-phenyl-3,3a-dihydropyrrolo[3,2-b][1,4]benzothiazin-2-one
SYSTEMATIC NAME: 1-phenyl-3,3a-dihydropyrrolo[3,2-b][1,4]benzothiazin-2-one
MOLECULAR FORMULA: C16H12N2OS
MOLECULAR WEIGHT: 280.34428
SMILES: C1C2C(=NC3=CC=CC=C3S2)N(C1=O)C4=CC=CC=C4
Structure:

CAS RN: 2676-97-3
CAS Name: N-[2-(diethoxyphosphinothioylthio)ethyl]-N-ethyl-2-fluoroethanamine
OPENEYE Name: N-(2-diethoxyphosphinothioylsulfanylethyl)-N-ethyl-2-fluoro-ethanamine
IUPAC Name: N-(2-diethoxyphosphinothioylsulfanylethyl)-N-ethyl-2-fluoroethanamine
SYSTEMATIC NAME: N-(2-diethoxyphosphinothioylsulfanylethyl)-N-ethyl-2-fluoranyl-ethanamine
MOLECULAR FORMULA: C10H23FNO2PS2
MOLECULAR WEIGHT: 303.397284
SMILES: CCN(CCF)CCSP(=S)(OCC)OCC
Structure:

CAS RN: 2668-74-8
CAS Name: acetic acid [(8R,9S,10R,13S,14S,17R)-17-acetyl-10,13-dimethyl-3-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl] ester
OPENEYE Name: [(8R,9S,10R,13S,14S,17R)-17-acetyl-10,13-dimethyl-3-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl] acetate
IUPAC Name: [(8R,9S,10R,13S,14S,17R)-17-acetyl-10,13-dimethyl-3-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl] acetate
SYSTEMATIC NAME: [(8R,9S,10R,13S,14S,17R)-17-ethanoyl-10,13-dimethyl-3-oxidanylidene-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl] ethanoate
MOLECULAR FORMULA: C23H30O4
MOLECULAR WEIGHT: 370.4819
SMILES: CC(=O)[C@]1(CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CCC4=CC(=O)C=C[C@]34C)C)OC(=O)C
Structure:

CAS RN: 2667-40-5
CAS Name: phosphoric acid 2,2-bis(ethylthio)ethenyl diethyl ester
OPENEYE Name: 2,2-bis(ethylsulfanyl)vinyl diethyl phosphate
IUPAC Name: 2,2-bis(ethylsulfanyl)ethenyl diethyl phosphate
SYSTEMATIC NAME: 2,2-bis(ethylsulfanyl)ethenyl diethyl phosphate
MOLECULAR FORMULA: C10H21O4PS2
MOLECULAR WEIGHT: 300.375101
SMILES: CCOP(=O)(OCC)OC=C(SCC)SCC
Structure:

CAS RN: 2664-22-4
CAS Name: 1-(2-chlorophenyl)-4-(4-morpholinyl)-2-thiophen-2-yl-2-butanol hydrochloride
OPENEYE Name: 1-(2-chlorophenyl)-4-morpholino-2-(2-thienyl)butan-2-ol hydrochloride
IUPAC Name: 1-(2-chlorophenyl)-4-morpholin-4-yl-2-thiophen-2-ylbutan-2-ol hydrochloride
SYSTEMATIC NAME: 1-(2-chlorophenyl)-4-morpholin-4-yl-2-thiophen-2-yl-butan-2-ol hydrochloride
MOLECULAR FORMULA: C18H23Cl2NO2S
MOLECULAR WEIGHT: 388.35172
SMILES: C1COCCN1CCC(CC2=CC=CC=C2Cl)(C3=CC=CS3)O.Cl
Structure:

CAS RN: 2656-24-8
CAS Name: 1-(2-hydroxyphenyl)-3-(phenylmethyl)urea
OPENEYE Name: 1-benzyl-3-(2-hydroxyphenyl)urea
IUPAC Name: 1-benzyl-3-(2-hydroxyphenyl)urea
SYSTEMATIC NAME: 1-(2-hydroxyphenyl)-3-(phenylmethyl)urea
MOLECULAR FORMULA: C14H14N2O2
MOLECULAR WEIGHT: 242.27316
SMILES: C1=CC=C(C=C1)CNC(=O)NC2=CC=CC=C2O
Structure:

CAS RN: 2653-58-9
CAS Name: 1-(4-morpholinyl)-2-propyl-1-pentanone
OPENEYE Name: 1-morpholino-2-propyl-pentan-1-one
IUPAC Name: 1-morpholin-4-yl-2-propylpentan-1-one
SYSTEMATIC NAME: 1-morpholin-4-yl-2-propyl-pentan-1-one
MOLECULAR FORMULA: C12H23NO2
MOLECULAR WEIGHT: 213.31652
SMILES: CCCC(CCC)C(=O)N1CCOCC1
Structure:

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