Wednesday, August 7, 2013

All Chemical Compounds Information




Product OPENEYE NAME: 7-[(5-amino-5-carboxy-pentanoyl)amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
CAS Name: 7-[(5-amino-5-carboxy-1-oxopentyl)amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
IUPAC NAME: 7-[(5-amino-5-carboxypentanoyl)amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
SYSTEMATIC NAME: 7-[(5-azanyl-6-oxidanyl-6-oxidanylidene-hexanoyl)amino]-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
MOLECULAR FORMULA: C13H17N3O6S
MOLECULAR WEIGHT: 343.35558
SMILES: C1C=C(N2C(S1)C(C2=O)NC(=O)CCCC(C(=O)O)N)C(=O)O
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Product OPENEYE NAME: 7-[[(2E)-2-[5-(tert-butoxycarbonylamino)-1,2,4-thiadiazol-3-ylidene]-2-nitroso-acetyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
CAS Name: 7-[[(2E)-2-[5-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1,2,4-thiadiazol-3-ylidene]-2-nitroso-1-oxoethyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
IUPAC NAME: 7-[[(2E)-2-[5-[(2-methylpropan-2-yl)oxycarbonylamino]-1,2,4-thiadiazol-3-ylidene]-2-nitrosoacetyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
SYSTEMATIC NAME: 7-[[(2E)-2-[5-[(2-methylpropan-2-yl)oxycarbonylamino]-1,2,4-thiadiazol-3-ylidene]-2-nitroso-ethanoyl]amino]-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
MOLECULAR FORMULA: C16H18N6O7S2
MOLECULAR WEIGHT: 470.48012
SMILES: CC(C)(C)OC(=O)NC1=N/C(=C(/C(=O)NC2C3N(C2=O)C(=CCS3)C(=O)O)\N=O)/NS1
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Product OPENEYE NAME: 8-oxo-3-pyrrolidin-1-yl-7-[[2-(2-thienyl)acetyl]amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
CAS Name: 8-oxo-7-[(1-oxo-2-thiophen-2-ylethyl)amino]-3-(1-pyrrolidinyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
IUPAC NAME: 8-oxo-3-pyrrolidin-1-yl-7-[(2-thiophen-2-ylacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
SYSTEMATIC NAME: 8-oxidanylidene-3-pyrrolidin-1-yl-7-(2-thiophen-2-ylethanoylamino)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
MOLECULAR FORMULA: C17H19N3O4S2
MOLECULAR WEIGHT: 393.48046
SMILES: C1CCN(C1)C2=C(N3C(C(C3=O)NC(=O)CC4=CC=CS4)SC2)C(=O)O
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Product OPENEYE NAME: 7-[[(2E)-2-(5-amino-1,2,4-thiadiazol-3-yl)-2-(2-carboxy-1-methyl-ethoxy)imino-acetyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
CAS Name: 7-[[(2E)-2-(5-amino-1,2,4-thiadiazol-3-yl)-2-(1-carboxypropan-2-yloxyimino)-1-oxoethyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
IUPAC NAME: 7-[[(2E)-2-(5-amino-1,2,4-thiadiazol-3-yl)-2-(1-carboxypropan-2-yloxyimino)acetyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
SYSTEMATIC NAME: 7-[[(2E)-2-(5-azanyl-1,2,4-thiadiazol-3-yl)-2-(4-oxidanyl-4-oxidanylidene-butan-2-yl)oxyimino-ethanoyl]amino]-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
MOLECULAR FORMULA: C15H16N6O7S2
MOLECULAR WEIGHT: 456.45354
SMILES: CC(CC(=O)O)O/N=C(\C1=NSC(=N1)N)/C(=O)NC2C3N(C2=O)C(=CCS3)C(=O)O
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Product OPENEYE NAME: 7-[[(2Z)-2-[2-(tert-butoxycarbonylamino)thiazol-4-yl]-2-methoxyimino-acetyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
CAS Name: 7-[[(2Z)-2-methoxyimino-2-[2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-4-thiazolyl]-1-oxoethyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
IUPAC NAME: 7-[[(2Z)-2-methoxyimino-2-[2-[(2-methylpropan-2-yl)oxycarbonylamino]-1,3-thiazol-4-yl]acetyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
SYSTEMATIC NAME: 7-[[(2Z)-2-methoxyimino-2-[2-[(2-methylpropan-2-yl)oxycarbonylamino]-1,3-thiazol-4-yl]ethanoyl]amino]-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
MOLECULAR FORMULA: C18H21N5O7S2
MOLECULAR WEIGHT: 483.51864
SMILES: CC(C)(C)OC(=O)NC1=NC(=CS1)/C(=N/OC)/C(=O)NC2C3N(C2=O)C(=CCS3)C(=O)O
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Product OPENEYE NAME: 3-morpholino-8-oxo-7-[(2-phenoxyacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
CAS Name: 3-(4-morpholinyl)-8-oxo-7-[(1-oxo-2-phenoxyethyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
IUPAC NAME: 3-morpholin-4-yl-8-oxo-7-[(2-phenoxyacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
SYSTEMATIC NAME: 3-morpholin-4-yl-8-oxidanylidene-7-(2-phenoxyethanoylamino)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
MOLECULAR FORMULA: C19H21N3O6S
MOLECULAR WEIGHT: 419.45154
SMILES: C1COCCN1C2=C(N3C(C(C3=O)NC(=O)COC4=CC=CC=C4)SC2)C(=O)O
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Product OPENEYE NAME: 3-morpholino-8-oxo-7-(3-phenylpropanoylamino)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
CAS Name: 3-(4-morpholinyl)-8-oxo-7-[(1-oxo-3-phenylpropyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
IUPAC NAME: 3-morpholin-4-yl-8-oxo-7-(3-phenylpropanoylamino)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
SYSTEMATIC NAME: 3-morpholin-4-yl-8-oxidanylidene-7-(3-phenylpropanoylamino)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
MOLECULAR FORMULA: C20H23N3O5S
MOLECULAR WEIGHT: 417.47872
SMILES: C1COCCN1C2=C(N3C(C(C3=O)NC(=O)CCC4=CC=CC=C4)SC2)C(=O)O
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Product OPENEYE NAME: 8-oxo-7-[(2-phenoxyacetyl)amino]-3-(1-piperidyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
CAS Name: 8-oxo-7-[(1-oxo-2-phenoxyethyl)amino]-3-(1-piperidinyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
IUPAC NAME: 8-oxo-7-[(2-phenoxyacetyl)amino]-3-piperidin-1-yl-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
SYSTEMATIC NAME: 8-oxidanylidene-7-(2-phenoxyethanoylamino)-3-piperidin-1-yl-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
MOLECULAR FORMULA: C20H23N3O5S
MOLECULAR WEIGHT: 417.47872
SMILES: C1CCN(CC1)C2=C(N3C(C(C3=O)NC(=O)COC4=CC=CC=C4)SC2)C(=O)O
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Product OPENEYE NAME: 7-[[(2Z)-2-[5-(tert-butoxycarbonylamino)-1,2,4-thiadiazol-3-yl]-2-methoxyimino-acetyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
CAS Name: 7-[[(2Z)-2-methoxyimino-2-[5-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1,2,4-thiadiazol-3-yl]-1-oxoethyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
IUPAC NAME: 7-[[(2Z)-2-methoxyimino-2-[5-[(2-methylpropan-2-yl)oxycarbonylamino]-1,2,4-thiadiazol-3-yl]acetyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
SYSTEMATIC NAME: 7-[[(2Z)-2-methoxyimino-2-[5-[(2-methylpropan-2-yl)oxycarbonylamino]-1,2,4-thiadiazol-3-yl]ethanoyl]amino]-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
MOLECULAR FORMULA: C17H20N6O7S2
MOLECULAR WEIGHT: 484.5067
SMILES: CC(C)(C)OC(=O)NC1=NC(=NS1)/C(=N/OC)/C(=O)NC2C3N(C2=O)C(=CCS3)C(=O)O
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Product OPENEYE NAME: 7-[[(2E)-2-[5-(tert-butoxycarbonylamino)-1,2,4-thiadiazol-3-yl]-2-(2-carboxy-1-methyl-ethoxy)imino-acetyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
CAS Name: 7-[[(2E)-2-(1-carboxypropan-2-yloxyimino)-2-[5-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1,2,4-thiadiazol-3-yl]-1-oxoethyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
IUPAC NAME: 7-[[(2E)-2-(1-carboxypropan-2-yloxyimino)-2-[5-[(2-methylpropan-2-yl)oxycarbonylamino]-1,2,4-thiadiazol-3-yl]acetyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
SYSTEMATIC NAME: 7-[[(2E)-2-[5-[(2-methylpropan-2-yl)oxycarbonylamino]-1,2,4-thiadiazol-3-yl]-2-(4-oxidanyl-4-oxidanylidene-butan-2-yl)oxyimino-ethanoyl]amino]-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
MOLECULAR FORMULA: C20H24N6O9S2
MOLECULAR WEIGHT: 556.56936
SMILES: CC(CC(=O)O)O/N=C(\C1=NSC(=N1)NC(=O)OC(C)(C)C)/C(=O)NC2C3N(C2=O)C(=CCS3)C(=O)O
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Product OPENEYE NAME: 7-[(2-amino-2-cyclohexa-1,4-dien-1-yl-acetyl)amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
CAS Name: 7-[[2-amino-2-(1-cyclohexa-1,4-dienyl)-1-oxoethyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
IUPAC NAME: 7-[(2-amino-2-cyclohexa-1,4-dien-1-ylacetyl)amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
SYSTEMATIC NAME: 7-[(2-azanyl-2-cyclohexa-1,4-dien-1-yl-ethanoyl)amino]-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
MOLECULAR FORMULA: C15H17N3O4S
MOLECULAR WEIGHT: 335.37818
SMILES: C1C=CCC(=C1)C(C(=O)NC2C3N(C2=O)C(=CCS3)C(=O)O)N
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Product OPENEYE NAME: 7-[[2-(tert-butoxycarbonylamino)-2-cyclohexa-1,4-dien-1-yl-acetyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
CAS Name: 7-[[2-(1-cyclohexa-1,4-dienyl)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxoethyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
IUPAC NAME: 7-[[2-cyclohexa-1,4-dien-1-yl-2-[(2-methylpropan-2-yl)oxycarbonylamino]acetyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
SYSTEMATIC NAME: 7-[[2-cyclohexa-1,4-dien-1-yl-2-[(2-methylpropan-2-yl)oxycarbonylamino]ethanoyl]amino]-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
MOLECULAR FORMULA: C20H25N3O6S
MOLECULAR WEIGHT: 435.494
SMILES: CC(C)(C)OC(=O)NC(C1=CCC=CC1)C(=O)NC2C3N(C2=O)C(=CCS3)C(=O)O
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Product OPENEYE NAME: 7-[[(2E)-2-methoxyiminoacetyl]-[5-(methylamino)-1,2,4-thiadiazol-3-yl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
CAS Name: 7-[[(2E)-2-methoxyimino-1-oxoethyl]-[5-(methylamino)-1,2,4-thiadiazol-3-yl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
IUPAC NAME: 7-[[(2E)-2-methoxyiminoacetyl]-[5-(methylamino)-1,2,4-thiadiazol-3-yl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
SYSTEMATIC NAME: 7-[[(2E)-2-methoxyiminoethanoyl]-[5-(methylamino)-1,2,4-thiadiazol-3-yl]amino]-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
MOLECULAR FORMULA: C13H14N6O5S2
MOLECULAR WEIGHT: 398.41746
SMILES: CNC1=NC(=NS1)N(C2C3N(C2=O)C(=CCS3)C(=O)O)C(=O)/C=N/OC
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Product OPENEYE NAME: 8-oxo-7-(3-phenylpropanoylamino)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
CAS Name: 8-oxo-7-[(1-oxo-3-phenylpropyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
IUPAC NAME: 8-oxo-7-(3-phenylpropanoylamino)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
SYSTEMATIC NAME: 8-oxidanylidene-7-(3-phenylpropanoylamino)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
MOLECULAR FORMULA: C16H16N2O4S
MOLECULAR WEIGHT: 332.37424
SMILES: C1C=C(N2C(S1)C(C2=O)NC(=O)CCC3=CC=CC=C3)C(=O)O
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Product OPENEYE NAME: 7-[[(2E)-2-(5-amino-1,2,4-thiadiazol-3-ylidene)-2-nitroso-acetyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
CAS Name: 7-[[(2E)-2-(5-amino-1,2,4-thiadiazol-3-ylidene)-2-nitroso-1-oxoethyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
IUPAC NAME: 7-[[(2E)-2-(5-amino-1,2,4-thiadiazol-3-ylidene)-2-nitrosoacetyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
SYSTEMATIC NAME: 7-[[(2E)-2-(5-azanyl-1,2,4-thiadiazol-3-ylidene)-2-nitroso-ethanoyl]amino]-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
MOLECULAR FORMULA: C11H10N6O5S2
MOLECULAR WEIGHT: 370.3643
SMILES: C1C=C(N2C(S1)C(C2=O)NC(=O)/C(=C/3\NSC(=N3)N)/N=O)C(=O)O
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Product OPENEYE NAME: N-[6-(1,3-dithiolan-2-yl)-2-oxo-3,6-diaza-1-azoniabicyclo[3.1.0]hexan-1-yl]formamide
CAS Name: N-[6-(1,3-dithiolan-2-yl)-2-oxo-3,6-diaza-1-azoniabicyclo[3.1.0]hexan-1-yl]formamide
IUPAC NAME: N-[6-(1,3-dithiolan-2-yl)-2-oxo-3,6-diaza-1-azoniabicyclo[3.1.0]hexan-1-yl]formamide
SYSTEMATIC NAME: N-[6-(1,3-dithiolan-2-yl)-2-oxidanylidene-3,6-diaza-1-azoniabicyclo[3.1.0]hexan-1-yl]methanamide
MOLECULAR FORMULA: C7H11N4O2S2+
MOLECULAR WEIGHT: 247.31784
SMILES: C1CSC(S1)N2C3[N+]2(C(=O)NC3)NC=O
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