Tuesday, July 30, 2013

All Chemical Compounds Information




Product OPENEYE NAME: 2,2,2-trichloroethyl (E)-2-(3-benzyl-7-oxo-4-thia-2,6-diazabicyclo[3.2.0]hept-2-en-6-yl)-3-morpholino-but-2-enoate
CAS Name: (E)-3-(4-morpholinyl)-2-[7-oxo-3-(phenylmethyl)-4-thia-2,6-diazabicyclo[3.2.0]hept-2-en-6-yl]-2-butenoic acid 2,2,2-trichloroethyl ester
IUPAC NAME: 2,2,2-trichloroethyl (E)-2-(3-benzyl-7-oxo-4-thia-2,6-diazabicyclo[3.2.0]hept-2-en-6-yl)-3-morpholin-4-ylbut-2-enoate
SYSTEMATIC NAME: 2,2,2-tris(chloranyl)ethyl (E)-3-morpholin-4-yl-2-[7-oxidanylidene-3-(phenylmethyl)-4-thia-2,6-diazabicyclo[3.2.0]hept-2-en-6-yl]but-2-enoate
MOLECULAR FORMULA: C21H22Cl3N3O4S
MOLECULAR WEIGHT: 518.84108
SMILES: C/C(=C(/C(=O)OCC(Cl)(Cl)Cl)\N1C2C(C1=O)N=C(S2)CC3=CC=CC=C3)/N4CCOCC4
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Product OPENEYE NAME: 1-sulfanylazetidine
CAS Name: 1-mercaptoazetidine
IUPAC NAME: 1-sulfanylazetidine
SYSTEMATIC NAME: 1-sulfanylazetidine
MOLECULAR FORMULA: C3H7NS
MOLECULAR WEIGHT: 89.15938
SMILES: C1CN(C1)S
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Product OPENEYE NAME: S-[3-[(2-cyanoacetyl)amino]-1-[(1Z)-1-[ethoxy(hydroxy)methylene]-2-oxo-propyl]-4-oxo-azetidin-2-yl] ethanethioate
CAS Name: ethanethioic acid S-[3-[(2-cyano-1-oxoethyl)amino]-1-[(Z)-1-ethoxy-1-hydroxy-3-oxobut-1-en-2-yl]-4-oxo-2-azetidinyl] ester
IUPAC NAME: S-[3-[(2-cyanoacetyl)amino]-1-[(Z)-1-ethoxy-1-hydroxy-3-oxobut-1-en-2-yl]-4-oxoazetidin-2-yl] ethanethioate
SYSTEMATIC NAME: S-[3-(2-cyanoethanoylamino)-1-[(Z)-1-ethoxy-1-oxidanyl-3-oxidanylidene-but-1-en-2-yl]-4-oxidanylidene-azetidin-2-yl] ethanethioate
MOLECULAR FORMULA: C14H17N3O6S
MOLECULAR WEIGHT: 355.36628
SMILES: CCO/C(=C(/C(=O)C)\N1C(C(C1=O)NC(=O)CC#N)SC(=O)C)/O
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Product OPENEYE NAME: phenacyl (Z)-4-bromo-2-[2-(2-ethoxy-2-oxo-ethyl)sulfanyl-4-oxo-3-(2,2,2-trichloroethoxycarbonylamino)azetidin-1-yl]-3-morpholino-but-2-enoate
CAS Name: (Z)-4-bromo-2-[2-[(2-ethoxy-2-oxoethyl)thio]-4-oxo-3-[[oxo(2,2,2-trichloroethoxy)methyl]amino]-1-azetidinyl]-3-(4-morpholinyl)-2-butenoic acid phenacyl ester
IUPAC NAME: phenacyl (Z)-4-bromo-2-[2-(2-ethoxy-2-oxoethyl)sulfanyl-4-oxo-3-(2,2,2-trichloroethoxycarbonylamino)azetidin-1-yl]-3-morpholin-4-ylbut-2-enoate
SYSTEMATIC NAME: phenacyl (Z)-4-bromanyl-2-[2-(2-ethoxy-2-oxidanylidene-ethyl)sulfanyl-4-oxidanylidene-3-[2,2,2-tris(chloranyl)ethoxycarbonylamino]azetidin-1-yl]-3-morpholin-4-yl-but-2-enoate
MOLECULAR FORMULA: C26H29BrCl3N3O9S
MOLECULAR WEIGHT: 745.85116
SMILES: CCOC(=O)CSC1C(C(=O)N1/C(=C(/CBr)\N2CCOCC2)/C(=O)OCC(=O)C3=CC=CC=C3)NC(=O)OCC(Cl)(Cl)Cl
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Product OPENEYE NAME: ethyl 2-[3-[(2-chloro-2-phenyl-acetyl)amino]-2-oxo-4-sulfanyl-azetidin-1-yl]-2-oxo-acetate
CAS Name: 2-[3-[(2-chloro-1-oxo-2-phenylethyl)amino]-2-mercapto-4-oxo-1-azetidinyl]-2-oxoacetic acid ethyl ester
IUPAC NAME: ethyl 2-[3-[(2-chloro-2-phenylacetyl)amino]-2-oxo-4-sulfanylazetidin-1-yl]-2-oxoacetate
SYSTEMATIC NAME: ethyl 2-[3-[(2-chloranyl-2-phenyl-ethanoyl)amino]-2-oxidanylidene-4-sulfanyl-azetidin-1-yl]-2-oxidanylidene-ethanoate
MOLECULAR FORMULA: C15H15ClN2O5S
MOLECULAR WEIGHT: 370.808
SMILES: CCOC(=O)C(=O)N1C(C(C1=O)NC(=O)C(C2=CC=CC=C2)Cl)S
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Product OPENEYE NAME: 6-oxabicyclo[3.1.1]hepta-1(7),2,4-triene; 2,2,2-trichloroethyl (E)-2-[3-acetamido-2-(cyclopropylmethoxycarbonylsulfanyl)-4-oxo-azetidin-1-yl]-3-(cyclopropylmethoxycarbonyloxy)but-2-enoate
CAS Name: (E)-2-[3-acetamido-2-[[cyclopropylmethoxy(oxo)methyl]thio]-4-oxo-1-azetidinyl]-3-[cyclopropylmethoxy(oxo)methoxy]-2-butenoic acid 2,2,2-trichloroethyl ester; 6-oxabicyclo[3.1.1]hepta-1(7),2,4-triene
IUPAC NAME: 6-oxabicyclo[3.1.1]hepta-1(7),2,4-triene; 2,2,2-trichloroethyl (E)-2-[3-acetamido-2-(cyclopropylmethoxycarbonylsulfanyl)-4-oxoazetidin-1-yl]-3-(cyclopropylmethoxycarbonyloxy)but-2-enoate
SYSTEMATIC NAME: 6-oxabicyclo[3.1.1]hepta-1(7),2,4-triene; 2,2,2-tris(chloranyl)ethyl (E)-2-[3-acetamido-2-(cyclopropylmethoxycarbonylsulfanyl)-4-oxidanylidene-azetidin-1-yl]-3-(cyclopropylmethoxycarbonyloxy)but-2-enoate
MOLECULAR FORMULA: C27H29Cl3N2O10S
MOLECULAR WEIGHT: 679.95056
SMILES: C/C(=C(/C(=O)OCC(Cl)(Cl)Cl)\N1C(C(C1=O)NC(=O)C)SC(=O)OCC2CC2)/OC(=O)OCC3CC3.C1=CC2=CC(=C1)O2
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Product OPENEYE NAME: 2,2,2-trichloroethyl (E)-2-[3-acetamido-2-(cyclopropylmethoxycarbonylsulfanyl)-4-oxo-azetidin-1-yl]-3-(cyclopropylmethoxycarbonyloxy)but-2-enoate
CAS Name: (E)-2-[3-acetamido-2-[[cyclopropylmethoxy(oxo)methyl]thio]-4-oxo-1-azetidinyl]-3-[cyclopropylmethoxy(oxo)methoxy]-2-butenoic acid 2,2,2-trichloroethyl ester
IUPAC NAME: 2,2,2-trichloroethyl (E)-2-[3-acetamido-2-(cyclopropylmethoxycarbonylsulfanyl)-4-oxoazetidin-1-yl]-3-(cyclopropylmethoxycarbonyloxy)but-2-enoate
SYSTEMATIC NAME: 2,2,2-tris(chloranyl)ethyl (E)-2-[3-acetamido-2-(cyclopropylmethoxycarbonylsulfanyl)-4-oxidanylidene-azetidin-1-yl]-3-(cyclopropylmethoxycarbonyloxy)but-2-enoate
MOLECULAR FORMULA: C21H25Cl3N2O9S
MOLECULAR WEIGHT: 587.8552
SMILES: C/C(=C(/C(=O)OCC(Cl)(Cl)Cl)\N1C(C(C1=O)NC(=O)C)SC(=O)OCC2CC2)/OC(=O)OCC3CC3
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Product OPENEYE NAME: (4-nitrophenyl)methyl 4-bromo-2-methylsulfonyl-3-morpholino-2-[7-oxo-3-(phenoxymethyl)-4-thia-2,6-diazabicyclo[3.2.0]hept-2-en-6-yl]butanoate
CAS Name: 4-bromo-2-methylsulfonyl-3-(4-morpholinyl)-2-[7-oxo-3-(phenoxymethyl)-4-thia-2,6-diazabicyclo[3.2.0]hept-2-en-6-yl]butanoic acid (4-nitrophenyl)methyl ester
IUPAC NAME: (4-nitrophenyl)methyl 4-bromo-2-methylsulfonyl-3-morpholin-4-yl-2-[7-oxo-3-(phenoxymethyl)-4-thia-2,6-diazabicyclo[3.2.0]hept-2-en-6-yl]butanoate
SYSTEMATIC NAME: (4-nitrophenyl)methyl 4-bromanyl-2-methylsulfonyl-3-morpholin-4-yl-2-[7-oxidanylidene-3-(phenoxymethyl)-4-thia-2,6-diazabicyclo[3.2.0]hept-2-en-6-yl]butanoate
MOLECULAR FORMULA: C27H29BrN4O9S2
MOLECULAR WEIGHT: 697.57456
SMILES: CS(=O)(=O)C(C(CBr)N1CCOCC1)(C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])N3C4C(C3=O)N=C(S4)COC5=CC=CC=C5
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Product OPENEYE NAME: N-[1-[(1Z)-3-bromo-1-[hydroxy-[(4-nitrophenyl)methoxy]methylene]-2-oxo-propyl]-2-(methoxymethylsulfanyl)-4-oxo-azetidin-3-yl]acetamide; 6-oxabicyclo[3.1.1]hepta-1(7),2,4-triene
CAS Name: N-[1-[(Z)-4-bromo-1-hydroxy-1-[(4-nitrophenyl)methoxy]-3-oxobut-1-en-2-yl]-2-(methoxymethylthio)-4-oxo-3-azetidinyl]acetamide; 6-oxabicyclo[3.1.1]hepta-1(7),2,4-triene
IUPAC NAME: N-[1-[(Z)-4-bromo-1-hydroxy-1-[(4-nitrophenyl)methoxy]-3-oxobut-1-en-2-yl]-2-(methoxymethylsulfanyl)-4-oxoazetidin-3-yl]acetamide; 6-oxabicyclo[3.1.1]hepta-1(7),2,4-triene
SYSTEMATIC NAME: N-[1-[(Z)-4-bromanyl-1-[(4-nitrophenyl)methoxy]-1-oxidanyl-3-oxidanylidene-but-1-en-2-yl]-2-(methoxymethylsulfanyl)-4-oxidanylidene-azetidin-3-yl]ethanamide; 6-oxabicyclo[3.1.1]hepta-1(7),2,4-triene
MOLECULAR FORMULA: C24H24BrN3O9S
MOLECULAR WEIGHT: 610.43106
SMILES: CC(=O)NC1C(N(C1=O)/C(=C(/O)\OCC2=CC=C(C=C2)[N+](=O)[O-])/C(=O)CBr)SCOC.C1=CC2=CC(=C1)O2
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Product OPENEYE NAME: N-[1-[(1Z)-3-bromo-1-[hydroxy-[(4-nitrophenyl)methoxy]methylene]-2-oxo-propyl]-2-(methoxymethylsulfanyl)-4-oxo-azetidin-3-yl]acetamide
CAS Name: N-[1-[(Z)-4-bromo-1-hydroxy-1-[(4-nitrophenyl)methoxy]-3-oxobut-1-en-2-yl]-2-(methoxymethylthio)-4-oxo-3-azetidinyl]acetamide
IUPAC NAME: N-[1-[(Z)-4-bromo-1-hydroxy-1-[(4-nitrophenyl)methoxy]-3-oxobut-1-en-2-yl]-2-(methoxymethylsulfanyl)-4-oxoazetidin-3-yl]acetamide
SYSTEMATIC NAME: N-[1-[(Z)-4-bromanyl-1-[(4-nitrophenyl)methoxy]-1-oxidanyl-3-oxidanylidene-but-1-en-2-yl]-2-(methoxymethylsulfanyl)-4-oxidanylidene-azetidin-3-yl]ethanamide
MOLECULAR FORMULA: C18H20BrN3O8S
MOLECULAR WEIGHT: 518.3357
SMILES: CC(=O)NC1C(N(C1=O)/C(=C(/O)\OCC2=CC=C(C=C2)[N+](=O)[O-])/C(=O)CBr)SCOC
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Product OPENEYE NAME: (E)-4-[2-(1,3-benzothiazol-2-yldisulfanyl)-4-oxo-3-[(2-phenoxyacetyl)amino]azetidin-1-yl]-3-(cyclopropylmethoxy)-5-oxo-5-(2,2,2-trichloroethoxy)pent-3-enoic acid
CAS Name: (E)-4-[2-(1,3-benzothiazol-2-yldisulfanyl)-4-oxo-3-[(1-oxo-2-phenoxyethyl)amino]-1-azetidinyl]-3-(cyclopropylmethoxy)-5-oxo-5-(2,2,2-trichloroethoxy)-3-pentenoic acid
IUPAC NAME: (E)-4-[2-(1,3-benzothiazol-2-yldisulfanyl)-4-oxo-3-[(2-phenoxyacetyl)amino]azetidin-1-yl]-3-(cyclopropylmethoxy)-5-oxo-5-(2,2,2-trichloroethoxy)pent-3-enoic acid
SYSTEMATIC NAME: (E)-4-[2-(1,3-benzothiazol-2-yldisulfanyl)-4-oxidanylidene-3-(2-phenoxyethanoylamino)azetidin-1-yl]-3-(cyclopropylmethoxy)-5-oxidanylidene-5-[2,2,2-tris(chloranyl)ethoxy]pent-3-enoic acid
MOLECULAR FORMULA: C29H26Cl3N3O8S3
MOLECULAR WEIGHT: 747.08604
SMILES: C1CC1CO/C(=C(\C(=O)OCC(Cl)(Cl)Cl)/N2C(C(C2=O)NC(=O)COC3=CC=CC=C3)SSC4=NC5=CC=CC=C5S4)/CC(=O)O
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Product OPENEYE NAME: cyclopropylmethyl [1-[(1E)-1-[benzhydryloxy(hydroxy)methylene]-2-oxo-propyl]-3-(tert-butoxycarbonylamino)-4-oxo-azetidin-2-yl]sulfanylformate
CAS Name: [[1-[(E)-1-(diphenylmethyl)oxy-1-hydroxy-3-oxobut-1-en-2-yl]-3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-4-oxo-2-azetidinyl]thio]formic acid cyclopropylmethyl ester
IUPAC NAME: cyclopropylmethyl [1-[(E)-1-benzhydryloxy-1-hydroxy-3-oxobut-1-en-2-yl]-3-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxoazetidin-2-yl]sulfanylformate
SYSTEMATIC NAME: cyclopropylmethyl [1-[(E)-1-(diphenylmethyl)oxy-1-oxidanyl-3-oxidanylidene-but-1-en-2-yl]-3-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxidanylidene-azetidin-2-yl]sulfanylmethanoate
MOLECULAR FORMULA: C30H34N2O8S
MOLECULAR WEIGHT: 582.66456
SMILES: CC(=O)/C(=C(/O)\OC(C1=CC=CC=C1)C2=CC=CC=C2)/N3C(C(C3=O)NC(=O)OC(C)(C)C)SC(=O)OCC4CC4
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Product OPENEYE NAME: 2,2,2-trichloroethyl (E)-3-morpholino-2-[7-oxo-3-(phenoxymethyl)-4-thia-2,6-diazabicyclo[3.2.0]hept-2-en-6-yl]but-2-enoate
CAS Name: (E)-3-(4-morpholinyl)-2-[7-oxo-3-(phenoxymethyl)-4-thia-2,6-diazabicyclo[3.2.0]hept-2-en-6-yl]-2-butenoic acid 2,2,2-trichloroethyl ester
IUPAC NAME: 2,2,2-trichloroethyl (E)-3-morpholin-4-yl-2-[7-oxo-3-(phenoxymethyl)-4-thia-2,6-diazabicyclo[3.2.0]hept-2-en-6-yl]but-2-enoate
SYSTEMATIC NAME: 2,2,2-tris(chloranyl)ethyl (E)-3-morpholin-4-yl-2-[7-oxidanylidene-3-(phenoxymethyl)-4-thia-2,6-diazabicyclo[3.2.0]hept-2-en-6-yl]but-2-enoate
MOLECULAR FORMULA: C21H22Cl3N3O5S
MOLECULAR WEIGHT: 534.84048
SMILES: C/C(=C(/C(=O)OCC(Cl)(Cl)Cl)\N1C2C(C1=O)N=C(S2)COC3=CC=CC=C3)/N4CCOCC4
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Product OPENEYE NAME: N-[2-(1,3-benzothiazol-2-yldisulfanyl)-1-[(1Z)-1-[hydroxy(2,2,2-trichloroethoxy)methylene]-2-oxo-propyl]-4-oxo-azetidin-3-yl]-2-phenoxy-acetamide
CAS Name: N-[2-(1,3-benzothiazol-2-yldisulfanyl)-1-[(Z)-1-hydroxy-3-oxo-1-(2,2,2-trichloroethoxy)but-1-en-2-yl]-4-oxo-3-azetidinyl]-2-phenoxyacetamide
IUPAC NAME: N-[2-(1,3-benzothiazol-2-yldisulfanyl)-1-[(Z)-1-hydroxy-3-oxo-1-(2,2,2-trichloroethoxy)but-1-en-2-yl]-4-oxoazetidin-3-yl]-2-phenoxyacetamide
SYSTEMATIC NAME: N-[2-(1,3-benzothiazol-2-yldisulfanyl)-4-oxidanylidene-1-[(Z)-1-oxidanyl-3-oxidanylidene-1-[2,2,2-tris(chloranyl)ethoxy]but-1-en-2-yl]azetidin-3-yl]-2-phenoxy-ethanamide
MOLECULAR FORMULA: C24H20Cl3N3O6S3
MOLECULAR WEIGHT: 648.9861
SMILES: CC(=O)/C(=C(\O)/OCC(Cl)(Cl)Cl)/N1C(C(C1=O)NC(=O)COC2=CC=CC=C2)SSC3=NC4=CC=CC=C4S3
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Product OPENEYE NAME: (E)-3-methoxycarbonyloxy-2-[7-oxo-3-(phenoxymethyl)-4-thia-2,6-diazabicyclo[3.2.0]hept-2-en-6-yl]but-2-enoate
CAS Name: (E)-3-methoxycarbonyloxy-2-[7-oxo-3-(phenoxymethyl)-4-thia-2,6-diazabicyclo[3.2.0]hept-2-en-6-yl]-2-butenoate
IUPAC NAME: (E)-3-methoxycarbonyloxy-2-[7-oxo-3-(phenoxymethyl)-4-thia-2,6-diazabicyclo[3.2.0]hept-2-en-6-yl]but-2-enoate
SYSTEMATIC NAME: (E)-3-methoxycarbonyloxy-2-[7-oxidanylidene-3-(phenoxymethyl)-4-thia-2,6-diazabicyclo[3.2.0]hept-2-en-6-yl]but-2-enoate
MOLECULAR FORMULA: C17H15N2O7S-
MOLECULAR WEIGHT: 391.3752
SMILES: C/C(=C(/C(=O)[O-])\N1C2C(C1=O)N=C(S2)COC3=CC=CC=C3)/OC(=O)OC
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