Thursday, August 8, 2013

All Chemical Compounds Information




Product OPENEYE NAME: 2-[[3-acetylsulfanyl-4-(4-methoxyphenyl)-4-oxo-butanoyl]amino]-3-(1H-indol-3-yl)propanoic acid
CAS Name: 2-[[3-(acetylthio)-4-(4-methoxyphenyl)-1,4-dioxobutyl]amino]-3-(1H-indol-3-yl)propanoic acid
IUPAC NAME: 2-[[3-acetylsulfanyl-4-(4-methoxyphenyl)-4-oxobutanoyl]amino]-3-(1H-indol-3-yl)propanoic acid
SYSTEMATIC NAME: 2-[[3-ethanoylsulfanyl-4-(4-methoxyphenyl)-4-oxidanylidene-butanoyl]amino]-3-(1H-indol-3-yl)propanoic acid
MOLECULAR FORMULA: C24H24N2O6S
MOLECULAR WEIGHT: 468.52216
SMILES: CC(=O)SC(CC(=O)NC(CC1=CNC2=CC=CC=C21)C(=O)O)C(=O)C3=CC=C(C=C3)OC
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Product OPENEYE NAME: 2-[[3-acetylsulfanyl-4-(4-tert-butylphenyl)-4-oxo-butanoyl]-methyl-amino]acetic acid
CAS Name: 2-[[3-(acetylthio)-4-(4-tert-butylphenyl)-1,4-dioxobutyl]-methylamino]acetic acid
IUPAC NAME: 2-[[3-acetylsulfanyl-4-(4-tert-butylphenyl)-4-oxobutanoyl]-methylamino]acetic acid
SYSTEMATIC NAME: 2-[[4-(4-tert-butylphenyl)-3-ethanoylsulfanyl-4-oxidanylidene-butanoyl]-methyl-amino]ethanoic acid
MOLECULAR FORMULA: C19H25NO5S
MOLECULAR WEIGHT: 379.4705
SMILES: CC(=O)SC(CC(=O)N(C)CC(=O)O)C(=O)C1=CC=C(C=C1)C(C)(C)C
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Product OPENEYE NAME: 2-[(3-acetylsulfanyl-4-indan-5-yl-4-oxo-butanoyl)amino]acetic acid
CAS Name: 2-[[3-(acetylthio)-4-(2,3-dihydro-1H-inden-5-yl)-1,4-dioxobutyl]amino]acetic acid
IUPAC NAME: 2-[[3-acetylsulfanyl-4-(2,3-dihydro-1H-inden-5-yl)-4-oxobutanoyl]amino]acetic acid
SYSTEMATIC NAME: 2-[[4-(2,3-dihydro-1H-inden-5-yl)-3-ethanoylsulfanyl-4-oxidanylidene-butanoyl]amino]ethanoic acid
MOLECULAR FORMULA: C17H19NO5S
MOLECULAR WEIGHT: 349.40146
SMILES: CC(=O)SC(CC(=O)NCC(=O)O)C(=O)C1=CC2=C(CCC2)C=C1
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Product OPENEYE NAME: 3-methyl-2-[[(E)-4-oxo-4-phenyl-but-2-enoyl]amino]butanoic acid
CAS Name: 2-[[(E)-1,4-dioxo-4-phenylbut-2-enyl]amino]-3-methylbutanoic acid
IUPAC NAME: 3-methyl-2-[[(E)-4-oxo-4-phenylbut-2-enoyl]amino]butanoic acid
SYSTEMATIC NAME: 3-methyl-2-[[(E)-4-oxidanylidene-4-phenyl-but-2-enoyl]amino]butanoic acid
MOLECULAR FORMULA: C15H17NO4
MOLECULAR WEIGHT: 275.29978
SMILES: CC(C)C(C(=O)O)NC(=O)/C=C/C(=O)C1=CC=CC=C1
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Product OPENEYE NAME: 2-[[3-acetylsulfanyl-4-(3-fluoro-4-methoxy-phenyl)-4-oxo-butanoyl]amino]-4-methylsulfanyl-butanoic acid
CAS Name: 2-[[3-(acetylthio)-4-(3-fluoro-4-methoxyphenyl)-1,4-dioxobutyl]amino]-4-(methylthio)butanoic acid
IUPAC NAME: 2-[[3-acetylsulfanyl-4-(3-fluoro-4-methoxyphenyl)-4-oxobutanoyl]amino]-4-methylsulfanylbutanoic acid
SYSTEMATIC NAME: 2-[[3-ethanoylsulfanyl-4-(3-fluoranyl-4-methoxy-phenyl)-4-oxidanylidene-butanoyl]amino]-4-methylsulfanyl-butanoic acid
MOLECULAR FORMULA: C18H22FNO6S2
MOLECULAR WEIGHT: 431.498783
SMILES: CC(=O)SC(CC(=O)NC(CCSC)C(=O)O)C(=O)C1=CC(=C(C=C1)OC)F
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Product OPENEYE NAME: 2-[[3-acetylsulfanyl-4-(4-bromophenyl)-4-oxo-butanoyl]amino]-4-methyl-pentanoic acid
CAS Name: 2-[[3-(acetylthio)-4-(4-bromophenyl)-1,4-dioxobutyl]amino]-4-methylpentanoic acid
IUPAC NAME: 2-[[3-acetylsulfanyl-4-(4-bromophenyl)-4-oxobutanoyl]amino]-4-methylpentanoic acid
SYSTEMATIC NAME: 2-[[4-(4-bromophenyl)-3-ethanoylsulfanyl-4-oxidanylidene-butanoyl]amino]-4-methyl-pentanoic acid
MOLECULAR FORMULA: C18H22BrNO5S
MOLECULAR WEIGHT: 444.33998
SMILES: CC(C)CC(C(=O)O)NC(=O)CC(C(=O)C1=CC=C(C=C1)Br)SC(=O)C
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Product OPENEYE NAME: 2-[[3-acetylsulfanyl-4-[4-(4-chlorophenoxy)phenyl]-4-oxo-butanoyl]amino]-3-phenyl-propanoic acid
CAS Name: 2-[[3-(acetylthio)-4-[4-(4-chlorophenoxy)phenyl]-1,4-dioxobutyl]amino]-3-phenylpropanoic acid
IUPAC NAME: 2-[[3-acetylsulfanyl-4-[4-(4-chlorophenoxy)phenyl]-4-oxobutanoyl]amino]-3-phenylpropanoic acid
SYSTEMATIC NAME: 2-[[4-[4-(4-chloranylphenoxy)phenyl]-3-ethanoylsulfanyl-4-oxidanylidene-butanoyl]amino]-3-phenyl-propanoic acid
MOLECULAR FORMULA: C27H24ClNO6S
MOLECULAR WEIGHT: 526.00056
SMILES: CC(=O)SC(CC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)C2=CC=C(C=C2)OC3=CC=C(C=C3)Cl
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Product OPENEYE NAME: 2-[[4-(3-fluorophenyl)-4-oxo-butanoyl]amino]-3-phenyl-propanoic acid
CAS Name: 2-[[4-(3-fluorophenyl)-1,4-dioxobutyl]amino]-3-phenylpropanoic acid
IUPAC NAME: 2-[[4-(3-fluorophenyl)-4-oxobutanoyl]amino]-3-phenylpropanoic acid
SYSTEMATIC NAME: 2-[[4-(3-fluorophenyl)-4-oxidanylidene-butanoyl]amino]-3-phenyl-propanoic acid
MOLECULAR FORMULA: C19H18FNO4
MOLECULAR WEIGHT: 343.348923
SMILES: C1=CC=C(C=C1)CC(C(=O)O)NC(=O)CCC(=O)C2=CC(=CC=C2)F
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Product OPENEYE NAME: 2-[[3-acetylsulfanyl-4-(2-naphthyl)-4-oxo-butanoyl]amino]-3-methyl-butanoic acid
CAS Name: 2-[[3-(acetylthio)-4-(2-naphthalenyl)-1,4-dioxobutyl]amino]-3-methylbutanoic acid
IUPAC NAME: 2-[(3-acetylsulfanyl-4-naphthalen-2-yl-4-oxobutanoyl)amino]-3-methylbutanoic acid
SYSTEMATIC NAME: 2-[(3-ethanoylsulfanyl-4-naphthalen-2-yl-4-oxidanylidene-butanoyl)amino]-3-methyl-butanoic acid
MOLECULAR FORMULA: C21H23NO5S
MOLECULAR WEIGHT: 401.47602
SMILES: CC(C)C(C(=O)O)NC(=O)CC(C(=O)C1=CC2=CC=CC=C2C=C1)SC(=O)C
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Product OPENEYE NAME: 2-[[2-acetylsulfanyl-4-(4-tert-butylphenyl)-4-oxo-butanoyl]amino]-3-phenyl-propanoic acid
CAS Name: 2-[[2-(acetylthio)-4-(4-tert-butylphenyl)-1,4-dioxobutyl]amino]-3-phenylpropanoic acid
IUPAC NAME: 2-[[2-acetylsulfanyl-4-(4-tert-butylphenyl)-4-oxobutanoyl]amino]-3-phenylpropanoic acid
SYSTEMATIC NAME: 2-[[4-(4-tert-butylphenyl)-2-ethanoylsulfanyl-4-oxidanylidene-butanoyl]amino]-3-phenyl-propanoic acid
MOLECULAR FORMULA: C25H29NO5S
MOLECULAR WEIGHT: 455.56646
SMILES: CC(=O)SC(CC(=O)C1=CC=C(C=C1)C(C)(C)C)C(=O)NC(CC2=CC=CC=C2)C(=O)O
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Product OPENEYE NAME: 2-[[3-acetylsulfanyl-4-(4-methoxyphenyl)-4-oxo-butanoyl]amino]-5-amino-5-oxo-pentanoic acid
CAS Name: 2-[[3-(acetylthio)-4-(4-methoxyphenyl)-1,4-dioxobutyl]amino]-5-amino-5-oxopentanoic acid
IUPAC NAME: 2-[[3-acetylsulfanyl-4-(4-methoxyphenyl)-4-oxobutanoyl]amino]-5-amino-5-oxopentanoic acid
SYSTEMATIC NAME: 5-azanyl-2-[[3-ethanoylsulfanyl-4-(4-methoxyphenyl)-4-oxidanylidene-butanoyl]amino]-5-oxidanylidene-pentanoic acid
MOLECULAR FORMULA: C18H22N2O7S
MOLECULAR WEIGHT: 410.44148
SMILES: CC(=O)SC(CC(=O)NC(CCC(=O)N)C(=O)O)C(=O)C1=CC=C(C=C1)OC
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Product OPENEYE NAME: 2-[[3-acetylsulfanyl-4-(1-naphthyl)-4-oxo-butanoyl]amino]-3-phenyl-propanoic acid
CAS Name: 2-[[3-(acetylthio)-4-(1-naphthalenyl)-1,4-dioxobutyl]amino]-3-phenylpropanoic acid
IUPAC NAME: 2-[(3-acetylsulfanyl-4-naphthalen-1-yl-4-oxobutanoyl)amino]-3-phenylpropanoic acid
SYSTEMATIC NAME: 2-[(3-ethanoylsulfanyl-4-naphthalen-1-yl-4-oxidanylidene-butanoyl)amino]-3-phenyl-propanoic acid
MOLECULAR FORMULA: C25H23NO5S
MOLECULAR WEIGHT: 449.51882
SMILES: CC(=O)SC(CC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)C2=CC=CC3=CC=CC=C32
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Product OPENEYE NAME: 2-[[3-acetylsulfanyl-4-(2-naphthyl)-4-oxo-butanoyl]amino]-3-phenyl-propanoic acid
CAS Name: 2-[[3-(acetylthio)-4-(2-naphthalenyl)-1,4-dioxobutyl]amino]-3-phenylpropanoic acid
IUPAC NAME: 2-[(3-acetylsulfanyl-4-naphthalen-2-yl-4-oxobutanoyl)amino]-3-phenylpropanoic acid
SYSTEMATIC NAME: 2-[(3-ethanoylsulfanyl-4-naphthalen-2-yl-4-oxidanylidene-butanoyl)amino]-3-phenyl-propanoic acid
MOLECULAR FORMULA: C25H23NO5S
MOLECULAR WEIGHT: 449.51882
SMILES: CC(=O)SC(CC(=O)NC(CC1=CC=CC=C1)C(=O)O)C(=O)C2=CC3=CC=CC=C3C=C2
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Product OPENEYE NAME: 2-[[3-acetylsulfanyl-4-(3,4-dichlorophenyl)-4-oxo-butanoyl]amino]propanoic acid
CAS Name: 2-[[3-(acetylthio)-4-(3,4-dichlorophenyl)-1,4-dioxobutyl]amino]propanoic acid
IUPAC NAME: 2-[[3-acetylsulfanyl-4-(3,4-dichlorophenyl)-4-oxobutanoyl]amino]propanoic acid
SYSTEMATIC NAME: 2-[[4-(3,4-dichlorophenyl)-3-ethanoylsulfanyl-4-oxidanylidene-butanoyl]amino]propanoic acid
MOLECULAR FORMULA: C15H15Cl2NO5S
MOLECULAR WEIGHT: 392.2543
SMILES: CC(C(=O)O)NC(=O)CC(C(=O)C1=CC(=C(C=C1)Cl)Cl)SC(=O)C
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Product OPENEYE NAME: 2-[[3-acetylsulfanyl-2-methyl-4-oxo-4-(3,4,5-trimethoxyphenyl)butanoyl]amino]-3-methylsulfanyl-propanoic acid
CAS Name: 2-[[3-(acetylthio)-2-methyl-1,4-dioxo-4-(3,4,5-trimethoxyphenyl)butyl]amino]-3-(methylthio)propanoic acid
IUPAC NAME: 2-[[3-acetylsulfanyl-2-methyl-4-oxo-4-(3,4,5-trimethoxyphenyl)butanoyl]amino]-3-methylsulfanylpropanoic acid
SYSTEMATIC NAME: 2-[[3-ethanoylsulfanyl-2-methyl-4-oxidanylidene-4-(3,4,5-trimethoxyphenyl)butanoyl]amino]-3-methylsulfanyl-propanoic acid
MOLECULAR FORMULA: C20H27NO8S2
MOLECULAR WEIGHT: 473.56028
SMILES: CC(C(C(=O)C1=CC(=C(C(=C1)OC)OC)OC)SC(=O)C)C(=O)NC(CSC)C(=O)O
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Product OPENEYE NAME: 2-[[3-acetylsulfanyl-4-(2-naphthyl)-4-oxo-butanoyl]amino]propanoic acid
CAS Name: 2-[[3-(acetylthio)-4-(2-naphthalenyl)-1,4-dioxobutyl]amino]propanoic acid
IUPAC NAME: 2-[(3-acetylsulfanyl-4-naphthalen-2-yl-4-oxobutanoyl)amino]propanoic acid
SYSTEMATIC NAME: 2-[(3-ethanoylsulfanyl-4-naphthalen-2-yl-4-oxidanylidene-butanoyl)amino]propanoic acid
MOLECULAR FORMULA: C19H19NO5S
MOLECULAR WEIGHT: 373.42286
SMILES: CC(C(=O)O)NC(=O)CC(C(=O)C1=CC2=CC=CC=C2C=C1)SC(=O)C
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Product OPENEYE NAME: 2-[[3-acetylsulfanyl-4-oxo-4-(4-phenylphenyl)butanoyl]amino]-5-amino-5-oxo-pentanoic acid
CAS Name: 2-[[3-(acetylthio)-1,4-dioxo-4-(4-phenylphenyl)butyl]amino]-5-amino-5-oxopentanoic acid
IUPAC NAME: 2-[[3-acetylsulfanyl-4-oxo-4-(4-phenylphenyl)butanoyl]amino]-5-amino-5-oxopentanoic acid
SYSTEMATIC NAME: 5-azanyl-2-[[3-ethanoylsulfanyl-4-oxidanylidene-4-(4-phenylphenyl)butanoyl]amino]-5-oxidanylidene-pentanoic acid
MOLECULAR FORMULA: C23H24N2O6S
MOLECULAR WEIGHT: 456.51146
SMILES: CC(=O)SC(CC(=O)NC(CCC(=O)N)C(=O)O)C(=O)C1=CC=C(C=C1)C2=CC=CC=C2
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Product OPENEYE NAME: 2-[[3-acetylsulfanyl-4-(4-bromophenyl)-4-oxo-butanoyl]amino]-3-methylsulfanyl-propanoic acid
CAS Name: 2-[[3-(acetylthio)-4-(4-bromophenyl)-1,4-dioxobutyl]amino]-3-(methylthio)propanoic acid
IUPAC NAME: 2-[[3-acetylsulfanyl-4-(4-bromophenyl)-4-oxobutanoyl]amino]-3-methylsulfanylpropanoic acid
SYSTEMATIC NAME: 2-[[4-(4-bromophenyl)-3-ethanoylsulfanyl-4-oxidanylidene-butanoyl]amino]-3-methylsulfanyl-propanoic acid
MOLECULAR FORMULA: C16H18BrNO5S2
MOLECULAR WEIGHT: 448.35182
SMILES: CC(=O)SC(CC(=O)NC(CSC)C(=O)O)C(=O)C1=CC=C(C=C1)Br
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Product OPENEYE NAME: 2-[(2-acetylsulfanyl-4-oxo-4-phenyl-butanoyl)amino]-3-phenyl-propanoic acid
CAS Name: 2-[[2-(acetylthio)-1,4-dioxo-4-phenylbutyl]amino]-3-phenylpropanoic acid
IUPAC NAME: 2-[(2-acetylsulfanyl-4-oxo-4-phenylbutanoyl)amino]-3-phenylpropanoic acid
SYSTEMATIC NAME: 2-[(2-ethanoylsulfanyl-4-oxidanylidene-4-phenyl-butanoyl)amino]-3-phenyl-propanoic acid
MOLECULAR FORMULA: C21H21NO5S
MOLECULAR WEIGHT: 399.46014
SMILES: CC(=O)SC(CC(=O)C1=CC=CC=C1)C(=O)NC(CC2=CC=CC=C2)C(=O)O
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Product OPENEYE NAME: 2-[[3-acetylsulfanyl-2-methyl-4-(1-naphthyl)-4-oxo-butanoyl]-methyl-amino]acetic acid
CAS Name: 2-[[3-(acetylthio)-2-methyl-4-(1-naphthalenyl)-1,4-dioxobutyl]-methylamino]acetic acid
IUPAC NAME: 2-[(3-acetylsulfanyl-2-methyl-4-naphthalen-1-yl-4-oxobutanoyl)-methylamino]acetic acid
SYSTEMATIC NAME: 2-[(3-ethanoylsulfanyl-2-methyl-4-naphthalen-1-yl-4-oxidanylidene-butanoyl)-methyl-amino]ethanoic acid
MOLECULAR FORMULA: C20H21NO5S
MOLECULAR WEIGHT: 387.44944
SMILES: CC(C(C(=O)C1=CC=CC2=CC=CC=C21)SC(=O)C)C(=O)N(C)CC(=O)O
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Product OPENEYE NAME: 2-[(2-acetylsulfanyl-4-oxo-4-phenyl-butanoyl)amino]-5-amino-5-oxo-pentanoic acid
CAS Name: 2-[[2-(acetylthio)-1,4-dioxo-4-phenylbutyl]amino]-5-amino-5-oxopentanoic acid
IUPAC NAME: 2-[(2-acetylsulfanyl-4-oxo-4-phenylbutanoyl)amino]-5-amino-5-oxopentanoic acid
SYSTEMATIC NAME: 5-azanyl-2-[(2-ethanoylsulfanyl-4-oxidanylidene-4-phenyl-butanoyl)amino]-5-oxidanylidene-pentanoic acid
MOLECULAR FORMULA: C17H20N2O6S
MOLECULAR WEIGHT: 380.4155
SMILES: CC(=O)SC(CC(=O)C1=CC=CC=C1)C(=O)NC(CCC(=O)N)C(=O)O
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Product OPENEYE NAME: trityl carbonochloridate
CAS Name: carbonochloridic acid (triphenylmethyl) ester
IUPAC NAME: trityl carbonochloridate
SYSTEMATIC NAME: (triphenylmethyl) carbonochloridate
MOLECULAR FORMULA: C20H15ClO2
MOLECULAR WEIGHT: 322.7849
SMILES: C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)OC(=O)Cl
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Product OPENEYE NAME: 2-[[3-acetylsulfanyl-4-oxo-4-(4-phenylphenyl)butanoyl]amino]-4-methylsulfanyl-butanoic acid
CAS Name: 2-[[3-(acetylthio)-1,4-dioxo-4-(4-phenylphenyl)butyl]amino]-4-(methylthio)butanoic acid
IUPAC NAME: 2-[[3-acetylsulfanyl-4-oxo-4-(4-phenylphenyl)butanoyl]amino]-4-methylsulfanylbutanoic acid
SYSTEMATIC NAME: 2-[[3-ethanoylsulfanyl-4-oxidanylidene-4-(4-phenylphenyl)butanoyl]amino]-4-methylsulfanyl-butanoic acid
MOLECULAR FORMULA: C23H25NO5S2
MOLECULAR WEIGHT: 459.5783
SMILES: CC(=O)SC(CC(=O)NC(CCSC)C(=O)O)C(=O)C1=CC=C(C=C1)C2=CC=CC=C2
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