Friday, July 26, 2013

All Chemical Compounds Information



Product OPENEYE NAME: 8-oxo-7-[[(2E)-2-prop-2-ynoxyimino-2-[2-[(2,2,2-trifluoroacetyl)amino]thiazol-4-yl]acetyl]amino]-3-(pyridin-1-ium-1-ylmethyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
CAS Name: 8-oxo-7-[[(2E)-1-oxo-2-prop-2-ynoxyimino-2-[2-[(2,2,2-trifluoro-1-oxoethyl)amino]-4-thiazolyl]ethyl]amino]-3-(1-pyridin-1-iumylmethyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
IUPAC NAME: 8-oxo-7-[[(2E)-2-prop-2-ynoxyimino-2-[2-[(2,2,2-trifluoroacetyl)amino]-1,3-thiazol-4-yl]acetyl]amino]-3-(pyridin-1-ium-1-ylmethyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
SYSTEMATIC NAME: 8-oxidanylidene-7-[[(2E)-2-prop-2-ynoxyimino-2-[2-[2,2,2-tris(fluoranyl)ethanoylamino]-1,3-thiazol-4-yl]ethanoyl]amino]-3-(pyridin-1-ium-1-ylmethyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
MOLECULAR FORMULA: C23H17F3N6O6S2
MOLECULAR WEIGHT: 594.54289
SMILES: C#CCO/N=C(\C1=CSC(=N1)NC(=O)C(F)(F)F)/C(=O)NC2C3N(C2=O)C(=C(CS3)C[N+]4=CC=CC=C4)C(=O)[O-]
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Product OPENEYE NAME: 8-oxo-7-[[(2E)-2-prop-2-ynoxyimino-2-[2-[(2,2,2-trifluoroacetyl)amino]thiazol-4-yl]acetyl]amino]-3-(pyridin-1-ium-1-ylmethyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
CAS Name: 8-oxo-7-[[(2E)-1-oxo-2-prop-2-ynoxyimino-2-[2-[(2,2,2-trifluoro-1-oxoethyl)amino]-4-thiazolyl]ethyl]amino]-3-(1-pyridin-1-iumylmethyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
IUPAC NAME: 8-oxo-7-[[(2E)-2-prop-2-ynoxyimino-2-[2-[(2,2,2-trifluoroacetyl)amino]-1,3-thiazol-4-yl]acetyl]amino]-3-(pyridin-1-ium-1-ylmethyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
SYSTEMATIC NAME: 8-oxidanylidene-7-[[(2E)-2-prop-2-ynoxyimino-2-[2-[2,2,2-tris(fluoranyl)ethanoylamino]-1,3-thiazol-4-yl]ethanoyl]amino]-3-(pyridin-1-ium-1-ylmethyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
MOLECULAR FORMULA: C23H18F3N6O6S2+
MOLECULAR WEIGHT: 595.55083
SMILES: C#CCO/N=C(\C1=CSC(=N1)NC(=O)C(F)(F)F)/C(=O)NC2C3N(C2=O)C(=C(CS3)C[N+]4=CC=CC=C4)C(=O)O
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Product OPENEYE NAME: 7-[[(2E)-2-(2-aminothiazol-4-yl)-2-(methylsulfanylmethoxyimino)acetyl]amino]-8-oxo-3-(pyridin-1-ium-1-ylmethyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
CAS Name: 7-[[(2E)-2-(2-amino-4-thiazolyl)-2-[(methylthio)methoxyimino]-1-oxoethyl]amino]-8-oxo-3-(1-pyridin-1-iumylmethyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
IUPAC NAME: 7-[[(2E)-2-(2-amino-1,3-thiazol-4-yl)-2-(methylsulfanylmethoxyimino)acetyl]amino]-8-oxo-3-(pyridin-1-ium-1-ylmethyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
SYSTEMATIC NAME: 7-[[(2E)-2-(2-azanyl-1,3-thiazol-4-yl)-2-(methylsulfanylmethoxyimino)ethanoyl]amino]-8-oxidanylidene-3-(pyridin-1-ium-1-ylmethyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
MOLECULAR FORMULA: C20H20N6O5S3
MOLECULAR WEIGHT: 520.605
SMILES: CSCO/N=C(\C1=CSC(=N1)N)/C(=O)NC2C3N(C2=O)C(=C(CS3)C[N+]4=CC=CC=C4)C(=O)[O-]
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Product OPENEYE NAME: 7-[[(2E)-2-(2-aminothiazol-4-yl)-2-(methylsulfanylmethoxyimino)acetyl]amino]-8-oxo-3-(pyridin-1-ium-1-ylmethyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
CAS Name: 7-[[(2E)-2-(2-amino-4-thiazolyl)-2-[(methylthio)methoxyimino]-1-oxoethyl]amino]-8-oxo-3-(1-pyridin-1-iumylmethyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
IUPAC NAME: 7-[[(2E)-2-(2-amino-1,3-thiazol-4-yl)-2-(methylsulfanylmethoxyimino)acetyl]amino]-8-oxo-3-(pyridin-1-ium-1-ylmethyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
SYSTEMATIC NAME: 7-[[(2E)-2-(2-azanyl-1,3-thiazol-4-yl)-2-(methylsulfanylmethoxyimino)ethanoyl]amino]-8-oxidanylidene-3-(pyridin-1-ium-1-ylmethyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
MOLECULAR FORMULA: C20H21N6O5S3+
MOLECULAR WEIGHT: 521.61294
SMILES: CSCO/N=C(\C1=CSC(=N1)N)/C(=O)NC2C3N(C2=O)C(=C(CS3)C[N+]4=CC=CC=C4)C(=O)O
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Product OPENEYE NAME: 7-[[(2E)-2-(cyclopentoxyimino)-2-[2-[(2,2,2-trifluoroacetyl)amino]thiazol-4-yl]acetyl]amino]-8-oxo-3-(pyridin-1-ium-1-ylmethyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
CAS Name: 7-[[(2E)-2-cyclopentyloxyimino-1-oxo-2-[2-[(2,2,2-trifluoro-1-oxoethyl)amino]-4-thiazolyl]ethyl]amino]-8-oxo-3-(1-pyridin-1-iumylmethyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
IUPAC NAME: 7-[[(2E)-2-cyclopentyloxyimino-2-[2-[(2,2,2-trifluoroacetyl)amino]-1,3-thiazol-4-yl]acetyl]amino]-8-oxo-3-(pyridin-1-ium-1-ylmethyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
SYSTEMATIC NAME: 7-[[(2E)-2-cyclopentyloxyimino-2-[2-[2,2,2-tris(fluoranyl)ethanoylamino]-1,3-thiazol-4-yl]ethanoyl]amino]-8-oxidanylidene-3-(pyridin-1-ium-1-ylmethyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
MOLECULAR FORMULA: C25H23F3N6O6S2
MOLECULAR WEIGHT: 624.61193
SMILES: C1CCC(C1)O/N=C(\C2=CSC(=N2)NC(=O)C(F)(F)F)/C(=O)NC3C4N(C3=O)C(=C(CS4)C[N+]5=CC=CC=C5)C(=O)[O-]
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Product OPENEYE NAME: 7-[[(2E)-2-(cyclopentoxyimino)-2-[2-[(2,2,2-trifluoroacetyl)amino]thiazol-4-yl]acetyl]amino]-8-oxo-3-(pyridin-1-ium-1-ylmethyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
CAS Name: 7-[[(2E)-2-cyclopentyloxyimino-1-oxo-2-[2-[(2,2,2-trifluoro-1-oxoethyl)amino]-4-thiazolyl]ethyl]amino]-8-oxo-3-(1-pyridin-1-iumylmethyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
IUPAC NAME: 7-[[(2E)-2-cyclopentyloxyimino-2-[2-[(2,2,2-trifluoroacetyl)amino]-1,3-thiazol-4-yl]acetyl]amino]-8-oxo-3-(pyridin-1-ium-1-ylmethyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
SYSTEMATIC NAME: 7-[[(2E)-2-cyclopentyloxyimino-2-[2-[2,2,2-tris(fluoranyl)ethanoylamino]-1,3-thiazol-4-yl]ethanoyl]amino]-8-oxidanylidene-3-(pyridin-1-ium-1-ylmethyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
MOLECULAR FORMULA: C25H24F3N6O6S2+
MOLECULAR WEIGHT: 625.61987
SMILES: C1CCC(C1)O/N=C(\C2=CSC(=N2)NC(=O)C(F)(F)F)/C(=O)NC3C4N(C3=O)C(=C(CS4)C[N+]5=CC=CC=C5)C(=O)O
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Product OPENEYE NAME: 7-[[(2E)-2-allyloxyimino-2-[2-[(2,2,2-trifluoroacetyl)amino]thiazol-4-yl]acetyl]amino]-8-oxo-3-(pyridin-1-ium-1-ylmethyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
CAS Name: 8-oxo-7-[[(2E)-1-oxo-2-prop-2-enoxyimino-2-[2-[(2,2,2-trifluoro-1-oxoethyl)amino]-4-thiazolyl]ethyl]amino]-3-(1-pyridin-1-iumylmethyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
IUPAC NAME: 8-oxo-7-[[(2E)-2-prop-2-enoxyimino-2-[2-[(2,2,2-trifluoroacetyl)amino]-1,3-thiazol-4-yl]acetyl]amino]-3-(pyridin-1-ium-1-ylmethyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
SYSTEMATIC NAME: 8-oxidanylidene-7-[[(2E)-2-prop-2-enoxyimino-2-[2-[2,2,2-tris(fluoranyl)ethanoylamino]-1,3-thiazol-4-yl]ethanoyl]amino]-3-(pyridin-1-ium-1-ylmethyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
MOLECULAR FORMULA: C23H19F3N6O6S2
MOLECULAR WEIGHT: 596.55877
SMILES: C=CCO/N=C(\C1=CSC(=N1)NC(=O)C(F)(F)F)/C(=O)NC2C3N(C2=O)C(=C(CS3)C[N+]4=CC=CC=C4)C(=O)[O-]
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Product OPENEYE NAME: 7-[[(2E)-2-allyloxyimino-2-[2-[(2,2,2-trifluoroacetyl)amino]thiazol-4-yl]acetyl]amino]-8-oxo-3-(pyridin-1-ium-1-ylmethyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
CAS Name: 8-oxo-7-[[(2E)-1-oxo-2-prop-2-enoxyimino-2-[2-[(2,2,2-trifluoro-1-oxoethyl)amino]-4-thiazolyl]ethyl]amino]-3-(1-pyridin-1-iumylmethyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
IUPAC NAME: 8-oxo-7-[[(2E)-2-prop-2-enoxyimino-2-[2-[(2,2,2-trifluoroacetyl)amino]-1,3-thiazol-4-yl]acetyl]amino]-3-(pyridin-1-ium-1-ylmethyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
SYSTEMATIC NAME: 8-oxidanylidene-7-[[(2E)-2-prop-2-enoxyimino-2-[2-[2,2,2-tris(fluoranyl)ethanoylamino]-1,3-thiazol-4-yl]ethanoyl]amino]-3-(pyridin-1-ium-1-ylmethyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
MOLECULAR FORMULA: C23H20F3N6O6S2+
MOLECULAR WEIGHT: 597.56671
SMILES: C=CCO/N=C(\C1=CSC(=N1)NC(=O)C(F)(F)F)/C(=O)NC2C3N(C2=O)C(=C(CS3)C[N+]4=CC=CC=C4)C(=O)O
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Product OPENEYE NAME: 1-methylpyridin-1-ium chloride hydrochloride
CAS Name: 1-methylpyridin-1-ium chloride hydrochloride
IUPAC NAME: 1-methylpyridin-1-ium chloride hydrochloride
SYSTEMATIC NAME: 1-methylpyridin-1-ium chloride hydrochloride
MOLECULAR FORMULA: C6H9Cl2N
MOLECULAR WEIGHT: 166.04836
SMILES: C[N+]1=CC=CC=C1.Cl.[Cl-]
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Product OPENEYE NAME: 7-[[(2E)-2-[(E)-4-tert-butoxy-4-oxo-but-2-enoxy]imino-2-(2-formamidothiazol-4-yl)acetyl]amino]-8-oxo-3-(pyridin-1-ium-1-ylmethyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
CAS Name: 7-[[(2E)-2-(2-formamido-4-thiazolyl)-2-[(E)-4-[(2-methylpropan-2-yl)oxy]-4-oxobut-2-enoxy]imino-1-oxoethyl]amino]-8-oxo-3-(1-pyridin-1-iumylmethyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
IUPAC NAME: 7-[[(2E)-2-(2-formamido-1,3-thiazol-4-yl)-2-[(E)-4-[(2-methylpropan-2-yl)oxy]-4-oxobut-2-enoxy]iminoacetyl]amino]-8-oxo-3-(pyridin-1-ium-1-ylmethyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
SYSTEMATIC NAME: 7-[[(2E)-2-(2-formamido-1,3-thiazol-4-yl)-2-[(E)-4-[(2-methylpropan-2-yl)oxy]-4-oxidanylidene-but-2-enoxy]imino-ethanoyl]amino]-8-oxidanylidene-3-(pyridin-1-ium-1-ylmethyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
MOLECULAR FORMULA: C27H28N6O8S2
MOLECULAR WEIGHT: 628.67662
SMILES: CC(C)(C)OC(=O)/C=C/CO/N=C(\C1=CSC(=N1)NC=O)/C(=O)NC2C3N(C2=O)C(=C(CS3)C[N+]4=CC=CC=C4)C(=O)[O-]
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