Tuesday, July 30, 2013

All Chemical Compounds Information




Product OPENEYE NAME: (4-nitrophenyl)methyl (E)-4-chloro-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)-4-chloro-3-(4-morpholinyl)-2-[7-oxo-3-(phenoxymethyl)-4-thia-2,6-diazabicyclo[3.2.0]hept-2-en-6-yl]-2-butenoic acid (4-nitrophenyl)methyl ester
IUPAC NAME: (4-nitrophenyl)methyl (E)-4-chloro-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: (4-nitrophenyl)methyl (E)-4-chloranyl-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: C26H25ClN4O7S
MOLECULAR WEIGHT: 573.0173
SMILES: C1COCCN1/C(=C(\C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])/N3C4C(C3=O)N=C(S4)COC5=CC=CC=C5)/CCl
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Product OPENEYE NAME: 3-phenyl-6-(2,2,2-trifluoroacetyl)-4-thia-2,6-diazabicyclo[3.2.0]hept-2-en-7-one
CAS Name: 3-phenyl-6-(2,2,2-trifluoro-1-oxoethyl)-4-thia-2,6-diazabicyclo[3.2.0]hept-2-en-7-one
IUPAC NAME: 3-phenyl-6-(2,2,2-trifluoroacetyl)-4-thia-2,6-diazabicyclo[3.2.0]hept-2-en-7-one
SYSTEMATIC NAME: 3-phenyl-6-[2,2,2-tris(fluoranyl)ethanoyl]-4-thia-2,6-diazabicyclo[3.2.0]hept-2-en-7-one
MOLECULAR FORMULA: C12H7F3N2O2S
MOLECULAR WEIGHT: 300.25639
SMILES: C1=CC=C(C=C1)C2=NC3C(S2)N(C3=O)C(=O)C(F)(F)F
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Product OPENEYE NAME: 3-benzyl-6-[(1Z)-1-[hydroxy(2,2,2-trichloroethoxy)methylene]-2-oxo-propyl]-4-thia-2,6-diazabicyclo[3.2.0]hept-2-en-7-one
CAS Name: 6-[(Z)-1-hydroxy-3-oxo-1-(2,2,2-trichloroethoxy)but-1-en-2-yl]-3-(phenylmethyl)-4-thia-2,6-diazabicyclo[3.2.0]hept-2-en-7-one
IUPAC NAME: 3-benzyl-6-[(Z)-1-hydroxy-3-oxo-1-(2,2,2-trichloroethoxy)but-1-en-2-yl]-4-thia-2,6-diazabicyclo[3.2.0]hept-2-en-7-one
SYSTEMATIC NAME: 6-[(Z)-1-oxidanyl-3-oxidanylidene-1-[2,2,2-tris(chloranyl)ethoxy]but-1-en-2-yl]-3-(phenylmethyl)-4-thia-2,6-diazabicyclo[3.2.0]hept-2-en-7-one
MOLECULAR FORMULA: C17H15Cl3N2O4S
MOLECULAR WEIGHT: 449.736
SMILES: CC(=O)/C(=C(\O)/OCC(Cl)(Cl)Cl)/N1C2C(C1=O)N=C(S2)CC3=CC=CC=C3
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Product OPENEYE NAME: benzyl (E)-4-methylsulfonyloxy-2-[7-oxo-3-(phenoxymethyl)-4-thia-2,6-diazabicyclo[3.2.0]hept-2-en-6-yl]but-2-enoate
CAS Name: (E)-4-methylsulfonyloxy-2-[7-oxo-3-(phenoxymethyl)-4-thia-2,6-diazabicyclo[3.2.0]hept-2-en-6-yl]-2-butenoic acid (phenylmethyl) ester
IUPAC NAME: benzyl (E)-4-methylsulfonyloxy-2-[7-oxo-3-(phenoxymethyl)-4-thia-2,6-diazabicyclo[3.2.0]hept-2-en-6-yl]but-2-enoate
SYSTEMATIC NAME: (phenylmethyl) (E)-4-methylsulfonyloxy-2-[7-oxidanylidene-3-(phenoxymethyl)-4-thia-2,6-diazabicyclo[3.2.0]hept-2-en-6-yl]but-2-enoate
MOLECULAR FORMULA: C23H22N2O7S2
MOLECULAR WEIGHT: 502.55998
SMILES: CS(=O)(=O)OC/C=C(\C(=O)OCC1=CC=CC=C1)/N2C3C(C2=O)N=C(S3)COC4=CC=CC=C4
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Product OPENEYE NAME: 2-[2-acetylsulfanyl-3-(1,3-dioxoisoindolin-2-yl)-4-oxo-azetidin-1-yl]-3-oxo-butanoic acid
CAS Name: 2-[2-(acetylthio)-3-(1,3-dioxo-2-isoindolyl)-4-oxo-1-azetidinyl]-3-oxobutanoic acid
IUPAC NAME: 2-[2-acetylsulfanyl-3-(1,3-dioxoisoindol-2-yl)-4-oxoazetidin-1-yl]-3-oxobutanoic acid
SYSTEMATIC NAME: 2-[3-[1,3-bis(oxidanylidene)isoindol-2-yl]-2-ethanoylsulfanyl-4-oxidanylidene-azetidin-1-yl]-3-oxidanylidene-butanoic acid
MOLECULAR FORMULA: C17H14N2O7S
MOLECULAR WEIGHT: 390.36726
SMILES: CC(=O)C(C(=O)O)N1C(C(C1=O)N2C(=O)C3=CC=CC=C3C2=O)SC(=O)C
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Product OPENEYE NAME: (4-nitrophenyl)methyl (Z)-2-(3-benzyl-7-oxo-4-thia-2,6-diazabicyclo[3.2.0]hept-2-en-6-yl)-4-bromo-3-(dimethylamino)but-2-enoate
CAS Name: (Z)-4-bromo-3-(dimethylamino)-2-[7-oxo-3-(phenylmethyl)-4-thia-2,6-diazabicyclo[3.2.0]hept-2-en-6-yl]-2-butenoic acid (4-nitrophenyl)methyl ester
IUPAC NAME: (4-nitrophenyl)methyl (Z)-2-(3-benzyl-7-oxo-4-thia-2,6-diazabicyclo[3.2.0]hept-2-en-6-yl)-4-bromo-3-(dimethylamino)but-2-enoate
SYSTEMATIC NAME: (4-nitrophenyl)methyl (Z)-4-bromanyl-3-(dimethylamino)-2-[7-oxidanylidene-3-(phenylmethyl)-4-thia-2,6-diazabicyclo[3.2.0]hept-2-en-6-yl]but-2-enoate
MOLECULAR FORMULA: C24H23BrN4O5S
MOLECULAR WEIGHT: 559.43222
SMILES: CN(C)/C(=C(/C(=O)OCC1=CC=C(C=C1)[N+](=O)[O-])\N2C3C(C2=O)N=C(S3)CC4=CC=CC=C4)/CBr
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Product OPENEYE NAME: benzyl (E)-2-(3-benzyl-7-oxo-4-thia-2,6-diazabicyclo[3.2.0]hept-2-en-6-yl)-3-methylsulfonyloxy-but-2-enoate
CAS Name: (E)-3-methylsulfonyloxy-2-[7-oxo-3-(phenylmethyl)-4-thia-2,6-diazabicyclo[3.2.0]hept-2-en-6-yl]-2-butenoic acid (phenylmethyl) ester
IUPAC NAME: benzyl (E)-2-(3-benzyl-7-oxo-4-thia-2,6-diazabicyclo[3.2.0]hept-2-en-6-yl)-3-methylsulfonyloxybut-2-enoate
SYSTEMATIC NAME: (phenylmethyl) (E)-3-methylsulfonyloxy-2-[7-oxidanylidene-3-(phenylmethyl)-4-thia-2,6-diazabicyclo[3.2.0]hept-2-en-6-yl]but-2-enoate
MOLECULAR FORMULA: C23H22N2O6S2
MOLECULAR WEIGHT: 486.56058
SMILES: C/C(=C(/C(=O)OCC1=CC=CC=C1)\N2C3C(C2=O)N=C(S3)CC4=CC=CC=C4)/OS(=O)(=O)C
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Product OPENEYE NAME: (4-nitrophenyl)methyl (E)-2-(3-benzyl-7-oxo-4-thia-2,6-diazabicyclo[3.2.0]hept-2-en-6-yl)-3-methylsulfonyloxy-but-2-enoate
CAS Name: (E)-3-methylsulfonyloxy-2-[7-oxo-3-(phenylmethyl)-4-thia-2,6-diazabicyclo[3.2.0]hept-2-en-6-yl]-2-butenoic acid (4-nitrophenyl)methyl ester
IUPAC NAME: (4-nitrophenyl)methyl (E)-2-(3-benzyl-7-oxo-4-thia-2,6-diazabicyclo[3.2.0]hept-2-en-6-yl)-3-methylsulfonyloxybut-2-enoate
SYSTEMATIC NAME: (4-nitrophenyl)methyl (E)-3-methylsulfonyloxy-2-[7-oxidanylidene-3-(phenylmethyl)-4-thia-2,6-diazabicyclo[3.2.0]hept-2-en-6-yl]but-2-enoate
MOLECULAR FORMULA: C23H21N3O8S2
MOLECULAR WEIGHT: 531.55814
SMILES: C/C(=C(/C(=O)OCC1=CC=C(C=C1)[N+](=O)[O-])\N2C3C(C2=O)N=C(S3)CC4=CC=CC=C4)/OS(=O)(=O)C
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Product OPENEYE NAME: benzyl N-[(2E)-2-[hydroxy(2,2,2-trichloroethoxy)methylene]-3,8-dioxo-5-thia-1-azabicyclo[4.2.0]octan-7-yl]carbamate
CAS Name: N-[(2E)-2-[hydroxy(2,2,2-trichloroethoxy)methylidene]-3,8-dioxo-5-thia-1-azabicyclo[4.2.0]octan-7-yl]carbamic acid (phenylmethyl) ester
IUPAC NAME: benzyl N-[(2E)-2-[hydroxy(2,2,2-trichloroethoxy)methylidene]-3,8-dioxo-5-thia-1-azabicyclo[4.2.0]octan-7-yl]carbamate
SYSTEMATIC NAME: (phenylmethyl) N-[(2E)-3,8-bis(oxidanylidene)-2-[oxidanyl-[2,2,2-tris(chloranyl)ethoxy]methylidene]-5-thia-1-azabicyclo[4.2.0]octan-7-yl]carbamate
MOLECULAR FORMULA: C17H15Cl3N2O6S
MOLECULAR WEIGHT: 481.7348
SMILES: C1C(=O)/C(=C(/O)\OCC(Cl)(Cl)Cl)/N2C(S1)C(C2=O)NC(=O)OCC3=CC=CC=C3
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Product OPENEYE NAME: ethyl 2-[3-[chloro(phenyl)methyl]-7-oxo-4-thia-2,6-diazabicyclo[3.2.0]hept-2-en-6-yl]-2-oxo-acetate
CAS Name: 2-[3-[chloro(phenyl)methyl]-7-oxo-4-thia-2,6-diazabicyclo[3.2.0]hept-2-en-6-yl]-2-oxoacetic acid ethyl ester
IUPAC NAME: ethyl 2-[3-[chloro(phenyl)methyl]-7-oxo-4-thia-2,6-diazabicyclo[3.2.0]hept-2-en-6-yl]-2-oxoacetate
SYSTEMATIC NAME: ethyl 2-[3-[chloranyl(phenyl)methyl]-7-oxidanylidene-4-thia-2,6-diazabicyclo[3.2.0]hept-2-en-6-yl]-2-oxidanylidene-ethanoate
MOLECULAR FORMULA: C15H13ClN2O4S
MOLECULAR WEIGHT: 352.79272
SMILES: CCOC(=O)C(=O)N1C2C(C1=O)N=C(S2)C(C3=CC=CC=C3)Cl
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Product OPENEYE NAME: (4-nitrophenyl)methyl (E)-2-[3-acetamido-2-(cyclopropylmethoxycarbonylsulfanyl)-4-oxo-azetidin-1-yl]-3-methoxycarbonyloxy-but-2-enoate; 6-oxabicyclo[3.1.1]hepta-1(7),2,4-triene
CAS Name: (E)-2-[3-acetamido-2-[[cyclopropylmethoxy(oxo)methyl]thio]-4-oxo-1-azetidinyl]-3-methoxycarbonyloxy-2-butenoic acid (4-nitrophenyl)methyl ester; 6-oxabicyclo[3.1.1]hepta-1(7),2,4-triene
IUPAC NAME: (4-nitrophenyl)methyl (E)-2-[3-acetamido-2-(cyclopropylmethoxycarbonylsulfanyl)-4-oxoazetidin-1-yl]-3-methoxycarbonyloxybut-2-enoate; 6-oxabicyclo[3.1.1]hepta-1(7),2,4-triene
SYSTEMATIC NAME: (4-nitrophenyl)methyl (E)-2-[3-acetamido-2-(cyclopropylmethoxycarbonylsulfanyl)-4-oxidanylidene-azetidin-1-yl]-3-methoxycarbonyloxy-but-2-enoate; 6-oxabicyclo[3.1.1]hepta-1(7),2,4-triene
MOLECULAR FORMULA: C29H29N3O12S
MOLECULAR WEIGHT: 643.61846
SMILES: C/C(=C(/C(=O)OCC1=CC=C(C=C1)[N+](=O)[O-])\N2C(C(C2=O)NC(=O)C)SC(=O)OCC3CC3)/OC(=O)OC.C1=CC2=CC(=C1)O2
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Product OPENEYE NAME: (4-nitrophenyl)methyl (E)-2-[3-acetamido-2-(cyclopropylmethoxycarbonylsulfanyl)-4-oxo-azetidin-1-yl]-3-methoxycarbonyloxy-but-2-enoate
CAS Name: (E)-2-[3-acetamido-2-[[cyclopropylmethoxy(oxo)methyl]thio]-4-oxo-1-azetidinyl]-3-methoxycarbonyloxy-2-butenoic acid (4-nitrophenyl)methyl ester
IUPAC NAME: (4-nitrophenyl)methyl (E)-2-[3-acetamido-2-(cyclopropylmethoxycarbonylsulfanyl)-4-oxoazetidin-1-yl]-3-methoxycarbonyloxybut-2-enoate
SYSTEMATIC NAME: (4-nitrophenyl)methyl (E)-2-[3-acetamido-2-(cyclopropylmethoxycarbonylsulfanyl)-4-oxidanylidene-azetidin-1-yl]-3-methoxycarbonyloxy-but-2-enoate
MOLECULAR FORMULA: C23H25N3O11S
MOLECULAR WEIGHT: 551.5231
SMILES: C/C(=C(/C(=O)OCC1=CC=C(C=C1)[N+](=O)[O-])\N2C(C(C2=O)NC(=O)C)SC(=O)OCC3CC3)/OC(=O)OC
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