Tuesday, December 27, 2011

All Chemical Compounds Information




Product OPENEYE NAME: 2-amino-N-(2-cyano-1,3-benzothiazol-6-yl)-3-(ethyldisulfanyl)propanamide
CAS Name: 2-amino-N-(2-cyano-1,3-benzothiazol-6-yl)-3-(ethyldisulfanyl)propanamide
IUPAC NAME: 2-amino-N-(2-cyano-1,3-benzothiazol-6-yl)-3-(ethyldisulfanyl)propanamide
SYSTEMATIC NAME: 2-azanyl-N-(2-cyano-1,3-benzothiazol-6-yl)-3-(ethyldisulfanyl)propanamide
MOLECULAR FORMULA: C13H14N4OS3
MOLECULAR WEIGHT: 338.47146
SMILES: CCSSCC(C(=O)NC1=CC2=C(C=C1)N=C(S2)C#N)N
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Product OPENEYE NAME: 4-[(2-acetamido-3-carboxy-propanoyl)amino]-5-[[1-[[1-(carboxymethyl)-2-[[2-[(2-cyano-1,3-benzothiazol-6-yl)amino]-2-oxo-1-(sulfanylmethyl)ethyl]amino]-2-oxo-ethyl]carbamoyl]-2-methyl-propyl]amino]-5-oxo-pentanoic acid
CAS Name: 4-[(2-acetamido-3-carboxy-1-oxopropyl)amino]-5-[[1-[[3-carboxy-1-[[1-[(2-cyano-1,3-benzothiazol-6-yl)amino]-3-mercapto-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]amino]-5-oxopentanoic acid
IUPAC NAME: 4-[(2-acetamido-3-carboxypropanoyl)amino]-5-[[1-[[3-carboxy-1-[[1-[(2-cyano-1,3-benzothiazol-6-yl)amino]-1-oxo-3-sulfanylpropan-2-yl]amino]-1-oxopropan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]amino]-5-oxopentanoic acid
SYSTEMATIC NAME: 4-[(2-acetamido-4-oxidanyl-4-oxidanylidene-butanoyl)amino]-5-[[1-[[1-[[1-[(2-cyano-1,3-benzothiazol-6-yl)amino]-1-oxidanylidene-3-sulfanyl-propan-2-yl]amino]-4-oxidanyl-1,4-bis(oxidanylidene)butan-2-yl]amino]-3-methyl-1-oxidanylidene-butan-2-yl]amino]-5-o
MOLECULAR FORMULA: C31H38N8O12S2
MOLECULAR WEIGHT: 778.80982
SMILES: CC(C)C(C(=O)NC(CC(=O)O)C(=O)NC(CS)C(=O)NC1=CC2=C(C=C1)N=C(S2)C#N)NC(=O)C(CCC(=O)O)NC(=O)C(CC(=O)O)NC(=O)C
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Product OPENEYE NAME:
CAS Name:
IUPAC NAME:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C67H88N20O12S4
MOLECULAR WEIGHT: 1493.80242
SMILES: CC(C)C(C(=O)NC(CCCNC(=N)N)C(=O)NC(CCCNC(=N)N)C(=O)NC(CSSC(C)(C)C)C(=O)NC(CCCCNC(=S)NC1=CC2=C(C=C1)C3(C4=C(C=C(C=C4)O)OC5=C3C=CC(=C5)O)OC2=O)C(=O)NC6=CC7=C(C=C6)N=C(S7)C#N)NC(=O)C(CCCNC(=N)N)NC(=O)C
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Product OPENEYE NAME: 2-[[2-[[2-[[2-[(2-amino-3-sulfanyl-propanoyl)amino]-5-guanidino-pentanoyl]amino]-3-methyl-butanoyl]amino]-5-guanidino-pentanoyl]amino]-N-(2-cyano-1,3-benzothiazol-6-yl)-5-guanidino-pentanamide
CAS Name: 2-[[2-[[2-[[2-[(2-amino-3-mercapto-1-oxopropyl)amino]-5-(diaminomethylideneamino)-1-oxopentyl]amino]-3-methyl-1-oxobutyl]amino]-5-(diaminomethylideneamino)-1-oxopentyl]amino]-N-(2-cyano-1,3-benzothiazol-6-yl)-5-(diaminomethylideneamino)pentanamide
IUPAC NAME: 2-[[2-[[2-[[2-[(2-amino-3-sulfanylpropanoyl)amino]-5-(diaminomethylideneamino)pentanoyl]amino]-3-methylbutanoyl]amino]-5-(diaminomethylideneamino)pentanoyl]amino]-N-(2-cyano-1,3-benzothiazol-6-yl)-5-(diaminomethylideneamino)pentanamide
SYSTEMATIC NAME: 2-[[2-[[2-[[2-[(2-azanyl-3-sulfanyl-propanoyl)amino]-5-[bis(azanyl)methylideneamino]pentanoyl]amino]-3-methyl-butanoyl]amino]-5-[bis(azanyl)methylideneamino]pentanoyl]amino]-5-[bis(azanyl)methylideneamino]-N-(2-cyano-1,3-benzothiazol-6-yl)pentanamide
MOLECULAR FORMULA: C34H55N17O5S2
MOLECULAR WEIGHT: 846.0414
SMILES: CC(C)C(C(=O)NC(CCCN=C(N)N)C(=O)NC(CCCN=C(N)N)C(=O)NC1=CC2=C(C=C1)N=C(S2)C#N)NC(=O)C(CCCN=C(N)N)NC(=O)C(CS)N
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Product OPENEYE NAME: 6-amino-2-[[2-amino-3-(ethyldisulfanyl)propanoyl]amino]-N-(2-cyano-1,3-benzothiazol-6-yl)hexanamide
CAS Name: 6-amino-2-[[2-amino-3-(ethyldisulfanyl)-1-oxopropyl]amino]-N-(2-cyano-1,3-benzothiazol-6-yl)hexanamide
IUPAC NAME: 6-amino-2-[[2-amino-3-(ethyldisulfanyl)propanoyl]amino]-N-(2-cyano-1,3-benzothiazol-6-yl)hexanamide
SYSTEMATIC NAME: 6-azanyl-2-[[2-azanyl-3-(ethyldisulfanyl)propanoyl]amino]-N-(2-cyano-1,3-benzothiazol-6-yl)hexanamide
MOLECULAR FORMULA: C19H26N6O2S3
MOLECULAR WEIGHT: 466.64374
SMILES: CCSSCC(C(=O)NC(CCCCN)C(=O)NC1=CC2=C(C=C1)N=C(S2)C#N)N
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Product OPENEYE NAME: 2-[[2-amino-3-(ethyldisulfanyl)propanoyl]amino]-N-(2-cyano-1,3-benzothiazol-6-yl)-6-[5-(2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl)pentanoylamino]hexanamide
CAS Name: 2-[[2-amino-3-(ethyldisulfanyl)-1-oxopropyl]amino]-N-(2-cyano-1,3-benzothiazol-6-yl)-6-[[1-oxo-5-(2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl)pentyl]amino]hexanamide
IUPAC NAME: 2-[[2-amino-3-(ethyldisulfanyl)propanoyl]amino]-N-(2-cyano-1,3-benzothiazol-6-yl)-6-[5-(2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl)pentanoylamino]hexanamide
SYSTEMATIC NAME: 2-[[2-azanyl-3-(ethyldisulfanyl)propanoyl]amino]-N-(2-cyano-1,3-benzothiazol-6-yl)-6-[5-(2-oxidanylidene-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl)pentanoylamino]hexanamide
MOLECULAR FORMULA: C29H40N8O4S4
MOLECULAR WEIGHT: 692.9391
SMILES: CCSSCC(C(=O)NC(CCCCNC(=O)CCCCC1C2C(CS1)NC(=O)N2)C(=O)NC3=CC4=C(C=C3)N=C(S4)C#N)N
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Product OPENEYE NAME: 2-acetamido-N-[1-[[1-[[1-[[2-[(2-cyano-1,3-benzothiazol-6-yl)amino]-2-oxo-1-(sulfanylmethyl)ethyl]carbamoyl]-4-guanidino-butyl]carbamoyl]-4-guanidino-butyl]carbamoyl]-2-methyl-propyl]-5-guanidino-pentanamide
CAS Name: 2-acetamido-N-[1-[[1-[[1-[[1-[(2-cyano-1,3-benzothiazol-6-yl)amino]-3-mercapto-1-oxopropan-2-yl]amino]-5-(diaminomethylideneamino)-1-oxopentan-2-yl]amino]-5-(diaminomethylideneamino)-1-oxopentan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]-5-(diaminomethylidenea
IUPAC NAME: 2-acetamido-N-[1-[[1-[[1-[[1-[(2-cyano-1,3-benzothiazol-6-yl)amino]-1-oxo-3-sulfanylpropan-2-yl]amino]-5-(diaminomethylideneamino)-1-oxopentan-2-yl]amino]-5-(diaminomethylideneamino)-1-oxopentan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]-5-(diaminomethylidenea
SYSTEMATIC NAME: 2-acetamido-5-[bis(azanyl)methylideneamino]-N-[1-[[5-[bis(azanyl)methylideneamino]-1-[[5-[bis(azanyl)methylideneamino]-1-[[1-[(2-cyano-1,3-benzothiazol-6-yl)amino]-1-oxidanylidene-3-sulfanyl-propan-2-yl]amino]-1-oxidanylidene-pentan-2-yl]amino]-1-oxidanyl
MOLECULAR FORMULA: C36H57N17O6S2
MOLECULAR WEIGHT: 888.07808
SMILES: CC(C)C(C(=O)NC(CCCN=C(N)N)C(=O)NC(CCCN=C(N)N)C(=O)NC(CS)C(=O)NC1=CC2=C(C=C1)N=C(S2)C#N)NC(=O)C(CCCN=C(N)N)NC(=O)C
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Product OPENEYE NAME: 3-[(6-chloro-1,3-benzothiazol-2-yl)-(3-phenylpropanoyl)amino]propyl-dimethyl-ammonium chloride
CAS Name: 3-[(6-chloro-1,3-benzothiazol-2-yl)-(1-oxo-3-phenylpropyl)amino]propyl-dimethylammonium chloride
IUPAC NAME: 3-[(6-chloro-1,3-benzothiazol-2-yl)-(3-phenylpropanoyl)amino]propyl-dimethylazanium chloride
SYSTEMATIC NAME: 3-[(6-chloranyl-1,3-benzothiazol-2-yl)-(3-phenylpropanoyl)amino]propyl-dimethyl-azanium chloride
MOLECULAR FORMULA: C21H25Cl2N3OS
MOLECULAR WEIGHT: 438.4137
SMILES: C[NH+](C)CCCN(C1=NC2=C(S1)C=C(C=C2)Cl)C(=O)CCC3=CC=CC=C3.[Cl-]
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Product OPENEYE NAME: 2-(3,4-dimethylanilino)-4-methyl-quinolin-1-ium-5-ol chloride
CAS Name: 2-(3,4-dimethylanilino)-4-methyl-5-quinolin-1-iumol chloride
IUPAC NAME: 2-(3,4-dimethylanilino)-4-methylquinolin-1-ium-5-ol chloride
SYSTEMATIC NAME: 2-[(3,4-dimethylphenyl)amino]-4-methyl-quinolin-1-ium-5-ol chloride
MOLECULAR FORMULA: C18H19ClN2O
MOLECULAR WEIGHT: 314.80926
SMILES: CC1=C(C=C(C=C1)NC2=[NH+]C3=C(C(=C2)C)C(=CC=C3)O)C.[Cl-]
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