Friday, September 30, 2011

http://ChemLookup.com Compounds




CAS RN: 121009-30-1
CAS Name: 1-(propan-2-ylamino)-3-(2-prop-2-enylphenoxy)-2-propanone oxime hydrochloride
OPENEYE Name: 1-(2-allylphenoxy)-3-(isopropylamino)propan-2-one oxime hydrochloride
IUPAC Name: (NE)-N-[1-(propan-2-ylamino)-3-(2-prop-2-enylphenoxy)propan-2-ylidene]hydroxylamine hydrochloride
SYSTEMATIC NAME: (NE)-N-[1-(propan-2-ylamino)-3-(2-prop-2-enylphenoxy)propan-2-ylidene]hydroxylamine hydrochloride
MOLECULAR FORMULA: C15H23ClN2O2
MOLECULAR WEIGHT: 298.80832
SMILES: CC(C)NC/C(=N\O)/COC1=CC=CC=C1CC=C.Cl
Structure:

CAS RN: 102585-93-3
CAS Name: N-(1,3-benzodioxol-5-yl)carbamic acid [(E)-(phenylmethylene)amino] ester
OPENEYE Name: [(E)-benzylideneamino] N-(1,3-benzodioxol-5-yl)carbamate
IUPAC Name: [(E)-benzylideneamino] N-(1,3-benzodioxol-5-yl)carbamate
SYSTEMATIC NAME: [(E)-(phenylmethylidene)amino] N-(1,3-benzodioxol-5-yl)carbamate
MOLECULAR FORMULA: C15H12N2O4
MOLECULAR WEIGHT: 284.26678
SMILES: C1OC2=C(O1)C=C(C=C2)NC(=O)O/N=C/C3=CC=CC=C3
Structure:

CAS RN: 101418-03-5
CAS Name: N-[(E)-dimethylaminomethylideneamino]carbamic acid (5-methyl-2-propan-2-ylcyclohexyl) ester
OPENEYE Name: (2-isopropyl-5-methyl-cyclohexyl) N-[(E)-dimethylaminomethyleneamino]carbamate
IUPAC Name: (5-methyl-2-propan-2-ylcyclohexyl) N-[(E)-dimethylaminomethylideneamino]carbamate
SYSTEMATIC NAME: (5-methyl-2-propan-2-yl-cyclohexyl) N-[(E)-dimethylaminomethylideneamino]carbamate
MOLECULAR FORMULA: C14H27N3O2
MOLECULAR WEIGHT: 269.38308
SMILES: CC1CCC(C(C1)OC(=O)N/N=C/N(C)C)C(C)C
Structure:

CAS RN: 101398-64-5
CAS Name: N'-(1-azepanyl)-N,N-dimethylmethanimidamide
OPENEYE Name: N'-(azepan-1-yl)-N,N-dimethyl-formamidine
IUPAC Name: N'-(azepan-1-yl)-N,N-dimethylmethanimidamide
SYSTEMATIC NAME: N'-(azepan-1-yl)-N,N-dimethyl-methanimidamide
MOLECULAR FORMULA: C9H19N3
MOLECULAR WEIGHT: 169.26726
SMILES: CN(C)/C=N/N1CCCCCC1
Structure:

CAS RN: 101398-52-1
CAS Name: N'-[4-cyano-5-(cyanomethyl)-2-phenyl-3-pyrazolyl]-N,N-dimethylmethanimidamide
OPENEYE Name: N'-[4-cyano-5-(cyanomethyl)-2-phenyl-pyrazol-3-yl]-N,N-dimethyl-formamidine
IUPAC Name: N'-[4-cyano-5-(cyanomethyl)-2-phenylpyrazol-3-yl]-N,N-dimethylmethanimidamide
SYSTEMATIC NAME: N'-[4-cyano-5-(cyanomethyl)-2-phenyl-pyrazol-3-yl]-N,N-dimethyl-methanimidamide
MOLECULAR FORMULA: C15H14N6
MOLECULAR WEIGHT: 278.31186
SMILES: CN(C)/C=N/C1=C(C(=NN1C2=CC=CC=C2)CC#N)C#N
Structure:

CAS RN: 91627-29-1
CAS Name: N-[(E)-(4-nitrophenyl)methylideneamino]-9-acridinamine
OPENEYE Name: N-[(E)-(4-nitrophenyl)methyleneamino]acridin-9-amine
IUPAC Name: N-[(E)-(4-nitrophenyl)methylideneamino]acridin-9-amine
SYSTEMATIC NAME: N-[(E)-(4-nitrophenyl)methylideneamino]acridin-9-amine
MOLECULAR FORMULA: C20H14N4O2
MOLECULAR WEIGHT: 342.35076
SMILES: C1=CC=C2C(=C1)C(=C3C=CC=CC3=N2)N/N=C/C4=CC=C(C=C4)[N+](=O)[O-]
Structure:

CAS RN: 86832-68-0
CAS Name: disodium 2-[(Z)-[1-(2-amino-4-thiazolyl)-2-[[(2S,3S)-2-(carbamoyloxymethyl)-4-oxo-1-sulfonato-3-azetidinyl]amino]-2-oxoethylidene]amino]oxyacetate
OPENEYE Name: disodium 2-[(Z)-[1-(2-aminothiazol-4-yl)-2-[[(2S,3S)-2-(carbamoyloxymethyl)-4-oxo-1-sulfonato-azetidin-3-yl]amino]-2-oxo-ethylidene]amino]oxyacetate
IUPAC Name: disodium 2-[(Z)-[1-(2-amino-1,3-thiazol-4-yl)-2-[[(2S,3S)-2-(carbamoyloxymethyl)-4-oxo-1-sulfonatoazetidin-3-yl]amino]-2-oxoethylidene]amino]oxyacetate
SYSTEMATIC NAME: disodium 2-[(Z)-[2-[[(2S,3S)-2-(aminocarbonyloxymethyl)-4-oxidanylidene-1-sulfonato-azetidin-3-yl]amino]-1-(2-azanyl-1,3-thiazol-4-yl)-2-oxidanylidene-ethylidene]amino]oxyethanoate
MOLECULAR FORMULA: C12H12N6Na2O10S2
MOLECULAR WEIGHT: 510.36742
SMILES: C1=C(N=C(S1)N)/C(=N/OCC(=O)[O-])/C(=O)N[C@H]2[C@H](N(C2=O)S(=O)(=O)[O-])COC(=O)N.[Na+].[Na+]
Structure:

CAS RN: 119141-88-7
CAS Name: 6-methoxy-2-[(S)-(4-methoxy-3,5-dimethyl-2-pyridinyl)methylsulfinyl]-1H-benzimidazole
OPENEYE Name: 6-methoxy-2-[(S)-(4-methoxy-3,5-dimethyl-2-pyridyl)methylsulfinyl]-1H-benzimidazole
IUPAC Name: 6-methoxy-2-[(S)-(4-methoxy-3,5-dimethylpyridin-2-yl)methylsulfinyl]-1H-benzimidazole
SYSTEMATIC NAME: 6-methoxy-2-[(S)-(4-methoxy-3,5-dimethyl-pyridin-2-yl)methylsulfinyl]-1H-benzimidazole
MOLECULAR FORMULA: C17H19N3O3S
MOLECULAR WEIGHT: 345.41606
SMILES: CC1=CN=C(C(=C1OC)C)C[S@](=O)C2=NC3=C(N2)C=C(C=C3)OC
Structure:

CAS RN: 51706-34-4
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C22H16N4O4
MOLECULAR WEIGHT: 400.38684
SMILES: C1=CC=C2C(C3=CC=CC=C3C=CC2=C1)/C=N/NC4=C(C=C(C=C4)[N+](=O)[O-])[N+](=O)[O-]
Structure:

CAS RN: 40392-27-6
CAS Name: N-[(E)-(2,4-dichlorophenyl)methylideneamino]formamide
OPENEYE Name: N-[(E)-(2,4-dichlorophenyl)methyleneamino]formamide
IUPAC Name: N-[(E)-(2,4-dichlorophenyl)methylideneamino]formamide
SYSTEMATIC NAME: N-[(E)-(2,4-dichlorophenyl)methylideneamino]methanamide
MOLECULAR FORMULA: C8H6Cl2N2O
MOLECULAR WEIGHT: 217.05204
SMILES: C1=CC(=C(C=C1Cl)Cl)/C=N/NC=O
Structure:

CAS RN: 133661-91-3
CAS Name: N-[(E)-(2-chlorophenyl)methylideneamino]formamide
OPENEYE Name: N-[(E)-(2-chlorophenyl)methyleneamino]formamide
IUPAC Name: N-[(E)-(2-chlorophenyl)methylideneamino]formamide
SYSTEMATIC NAME: N-[(E)-(2-chlorophenyl)methylideneamino]methanamide
MOLECULAR FORMULA: C8H7ClN2O
MOLECULAR WEIGHT: 182.60698
SMILES: C1=CC=C(C(=C1)/C=N/NC=O)Cl
Structure:

CAS RN: 18725-42-3
CAS Name: N-[(E)-1-naphthalenylmethylideneamino]-9-fluorenimine
OPENEYE Name: N-[(E)-1-naphthylmethyleneamino]fluoren-9-imine
IUPAC Name: N-[(E)-naphthalen-1-ylmethylideneamino]fluoren-9-imine
SYSTEMATIC NAME: N-[(E)-naphthalen-1-ylmethylideneamino]fluoren-9-imine
MOLECULAR FORMULA: C24H16N2
MOLECULAR WEIGHT: 332.39724
SMILES: C1=CC=C2C(=C1)C=CC=C2/C=N/N=C3C4=CC=CC=C4C5=CC=CC=C53
Structure:

CAS RN: 80287-15-6
CAS Name: N-[(E)-[(8E)-8-[(2,4-dinitrophenyl)hydrazinylidene]octylidene]amino]-2,4-dinitroaniline
OPENEYE Name: N-[(E)-[(8E)-8-[(2,4-dinitrophenyl)hydrazono]octylidene]amino]-2,4-dinitro-aniline
IUPAC Name: N-[(E)-[(8E)-8-[(2,4-dinitrophenyl)hydrazinylidene]octylidene]amino]-2,4-dinitroaniline
SYSTEMATIC NAME: N-[(E)-[(8E)-8-[(2,4-dinitrophenyl)hydrazinylidene]octylidene]amino]-2,4-dinitro-aniline
MOLECULAR FORMULA: C20H22N8O8
MOLECULAR WEIGHT: 502.43748
SMILES: C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])N/N=C/CCCCCC/C=N/NC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]
Structure:

CAS RN: 104-06-3
CAS Name: N-[4-[(E)-(carbamothioylhydrazinylidene)methyl]phenyl]acetamide
OPENEYE Name: N-[4-[(E)-(carbamothioylhydrazono)methyl]phenyl]acetamide
IUPAC Name: N-[4-[(E)-(carbamothioylhydrazinylidene)methyl]phenyl]acetamide
SYSTEMATIC NAME: N-[4-[(E)-(carbamothioylhydrazinylidene)methyl]phenyl]ethanamide
MOLECULAR FORMULA: C10H12N4OS
MOLECULAR WEIGHT: 236.29348
SMILES: CC(=O)NC1=CC=C(C=C1)/C=N/NC(=S)N
Structure:

CAS RN: 53145-08-7
CAS Name: 1-diethoxyphosphorylethanone oxime
OPENEYE Name: 1-diethoxyphosphorylethanone oxime
IUPAC Name: (NE)-N-(1-diethoxyphosphorylethylidene)hydroxylamine
SYSTEMATIC NAME: (NE)-N-(1-diethoxyphosphorylethylidene)hydroxylamine
MOLECULAR FORMULA: C6H14NO4P
MOLECULAR WEIGHT: 195.153421
SMILES: CCOP(=O)(/C(=N/O)/C)OCC
Structure:

CAS RN: 14796-28-2
CAS Name: 1-[(E)-[5-(3,4-dichlorophenyl)-2-furanyl]methylideneamino]imidazolidine-2,4-dione
OPENEYE Name: 1-[(E)-[5-(3,4-dichlorophenyl)-2-furyl]methyleneamino]imidazolidine-2,4-dione
IUPAC Name: 1-[(E)-[5-(3,4-dichlorophenyl)furan-2-yl]methylideneamino]imidazolidine-2,4-dione
SYSTEMATIC NAME: 1-[(E)-[5-(3,4-dichlorophenyl)furan-2-yl]methylideneamino]imidazolidine-2,4-dione
MOLECULAR FORMULA: C14H9Cl2N3O3
MOLECULAR WEIGHT: 338.14556
SMILES: C1C(=O)NC(=O)N1/N=C/C2=CC=C(O2)C3=CC(=C(C=C3)Cl)Cl
Structure:

CAS RN: 2804-16-2
CAS Name: N-[(E)-[4-[bis(2-chloroethyl)amino]phenyl]methylideneamino]-2-pyridinecarboxamide
OPENEYE Name: N-[(E)-[4-[bis(2-chloroethyl)amino]phenyl]methyleneamino]pyridine-2-carboxamide
IUPAC Name: N-[(E)-[4-[bis(2-chloroethyl)amino]phenyl]methylideneamino]pyridine-2-carboxamide
SYSTEMATIC NAME: N-[(E)-[4-[bis(2-chloroethyl)amino]phenyl]methylideneamino]pyridine-2-carboxamide
MOLECULAR FORMULA: C17H18Cl2N4O
MOLECULAR WEIGHT: 365.25702
SMILES: C1=CC=NC(=C1)C(=O)N/N=C/C2=CC=C(C=C2)N(CCCl)CCCl
Structure:

CAS RN: 27894-30-0
CAS Name: N1,N4-bis[(E)-(3-phenylmethoxyphenyl)methylideneamino]phthalazine-1,4-diamine
OPENEYE Name: N1,N4-bis[(E)-(3-benzyloxyphenyl)methyleneamino]phthalazine-1,4-diamine
IUPAC Name: 1-N,4-N-bis[(E)-(3-phenylmethoxyphenyl)methylideneamino]phthalazine-1,4-diamine
SYSTEMATIC NAME: N1,N4-bis[(E)-(3-phenylmethoxyphenyl)methylideneamino]phthalazine-1,4-diamine
MOLECULAR FORMULA: C36H30N6O2
MOLECULAR WEIGHT: 578.6624
SMILES: C1=CC=C(C=C1)COC2=CC=CC(=C2)/C=N/NC3=NN=C(C4=CC=CC=C34)N/N=C/C5=CC(=CC=C5)OCC6=CC=CC=C6
Structure:

CAS RN: 27913-70-8
CAS Name: N1,N4-bis[(E)-(2,5-dimethyl-1-phenyl-3-pyrrolyl)methylideneamino]phthalazine-1,4-diamine
OPENEYE Name: N1,N4-bis[(E)-(2,5-dimethyl-1-phenyl-pyrrol-3-yl)methyleneamino]phthalazine-1,4-diamine
IUPAC Name: 1-N,4-N-bis[(E)-(2,5-dimethyl-1-phenylpyrrol-3-yl)methylideneamino]phthalazine-1,4-diamine
SYSTEMATIC NAME: N1,N4-bis[(E)-(2,5-dimethyl-1-phenyl-pyrrol-3-yl)methylideneamino]phthalazine-1,4-diamine
MOLECULAR FORMULA: C34H32N8
MOLECULAR WEIGHT: 552.67148
SMILES: CC1=CC(=C(N1C2=CC=CC=C2)C)/C=N/NC3=NN=C(C4=CC=CC=C34)N/N=C/C5=C(N(C(=C5)C)C6=CC=CC=C6)C
Structure:

CAS RN: 27981-08-4
CAS Name: N1,N4-bis[(E)-(2,3-dimethoxyphenyl)methylideneamino]phthalazine-1,4-diamine
OPENEYE Name: N1,N4-bis[(E)-(2,3-dimethoxyphenyl)methyleneamino]phthalazine-1,4-diamine
IUPAC Name: 1-N,4-N-bis[(E)-(2,3-dimethoxyphenyl)methylideneamino]phthalazine-1,4-diamine
SYSTEMATIC NAME: N1,N4-bis[(E)-(2,3-dimethoxyphenyl)methylideneamino]phthalazine-1,4-diamine
MOLECULAR FORMULA: C26H26N6O4
MOLECULAR WEIGHT: 486.52244
SMILES: COC1=CC=CC(=C1OC)/C=N/NC2=NN=C(C3=CC=CC=C23)N/N=C/C4=C(C(=CC=C4)OC)OC
Structure:

CAS RN: 27891-39-0
CAS Name: N1,N4-bis[(E)-1-naphthalenylmethylideneamino]phthalazine-1,4-diamine
OPENEYE Name: N1,N4-bis[(E)-1-naphthylmethyleneamino]phthalazine-1,4-diamine
IUPAC Name: 1-N,4-N-bis[(E)-naphthalen-1-ylmethylideneamino]phthalazine-1,4-diamine
SYSTEMATIC NAME: N1,N4-bis[(E)-naphthalen-1-ylmethylideneamino]phthalazine-1,4-diamine
MOLECULAR FORMULA: C30H22N6
MOLECULAR WEIGHT: 466.53588
SMILES: C1=CC=C2C(=CC=CC2=C1)/C=N/NC3=NN=C(C4=CC=CC=C34)N/N=C/C5=CC=CC6=CC=CC=C56
Structure:

CAS RN: 2787-91-9
CAS Name: N1,N4-bis[(E)-(3-chlorophenyl)methylideneamino]phthalazine-1,4-diamine
OPENEYE Name: N1,N4-bis[(E)-(3-chlorophenyl)methyleneamino]phthalazine-1,4-diamine
IUPAC Name: 1-N,4-N-bis[(E)-(3-chlorophenyl)methylideneamino]phthalazine-1,4-diamine
SYSTEMATIC NAME: N1,N4-bis[(E)-(3-chlorophenyl)methylideneamino]phthalazine-1,4-diamine
MOLECULAR FORMULA: C22H16Cl2N6
MOLECULAR WEIGHT: 435.30864
SMILES: C1=CC=C2C(=NN=C(C2=C1)N/N=C/C3=CC(=CC=C3)Cl)N/N=C/C4=CC(=CC=C4)Cl
Structure:

CAS RN: 27905-45-9
CAS Name: N1,N4-bis[(E)-cyclohexylmethylideneamino]phthalazine-1,4-diamine
OPENEYE Name: N1,N4-bis[(E)-cyclohexylmethyleneamino]phthalazine-1,4-diamine
IUPAC Name: 1-N,4-N-bis[(E)-cyclohexylmethylideneamino]phthalazine-1,4-diamine
SYSTEMATIC NAME: N1,N4-bis[(E)-cyclohexylmethylideneamino]phthalazine-1,4-diamine
MOLECULAR FORMULA: C22H30N6
MOLECULAR WEIGHT: 378.5138
SMILES: C1CCC(CC1)/C=N/NC2=NN=C(C3=CC=CC=C23)N/N=C/C4CCCCC4
Structure:

CAS RN: 27892-33-7
CAS Name: N1,N4-bis[(E)-(4-methoxy-1-naphthalenyl)methylideneamino]phthalazine-1,4-diamine
OPENEYE Name: N1,N4-bis[(E)-(4-methoxy-1-naphthyl)methyleneamino]phthalazine-1,4-diamine
IUPAC Name: 1-N,4-N-bis[(E)-(4-methoxynaphthalen-1-yl)methylideneamino]phthalazine-1,4-diamine
SYSTEMATIC NAME: N1,N4-bis[(E)-(4-methoxynaphthalen-1-yl)methylideneamino]phthalazine-1,4-diamine
MOLECULAR FORMULA: C32H26N6O2
MOLECULAR WEIGHT: 526.58784
SMILES: COC1=CC=C(C2=CC=CC=C12)/C=N/NC3=NN=C(C4=CC=CC=C34)N/N=C/C5=CC=C(C6=CC=CC=C56)OC
Structure:

CAS RN: 27888-12-6
CAS Name: N1,N4-bis[(E)-(4-bromophenyl)methylideneamino]phthalazine-1,4-diamine
OPENEYE Name: N1,N4-bis[(E)-(4-bromophenyl)methyleneamino]phthalazine-1,4-diamine
IUPAC Name: 1-N,4-N-bis[(E)-(4-bromophenyl)methylideneamino]phthalazine-1,4-diamine
SYSTEMATIC NAME: N1,N4-bis[(E)-(4-bromophenyl)methylideneamino]phthalazine-1,4-diamine
MOLECULAR FORMULA: C22H16Br2N6
MOLECULAR WEIGHT: 524.21064
SMILES: C1=CC=C2C(=NN=C(C2=C1)N/N=C/C3=CC=C(C=C3)Br)N/N=C/C4=CC=C(C=C4)Br
Structure:

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