Friday, June 28, 2013

All Chemical Compounds Information




Product OPENEYE NAME: 3-(acetoxymethyl)-4-methyl-8-oxo-7-[[2-(2-thienyl)acetyl]amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
CAS Name: 3-(acetyloxymethyl)-4-methyl-8-oxo-7-[(1-oxo-2-thiophen-2-ylethyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
IUPAC NAME: 3-(acetyloxymethyl)-4-methyl-8-oxo-7-[(2-thiophen-2-ylacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
SYSTEMATIC NAME: 3-(acetyloxymethyl)-4-methyl-8-oxidanylidene-7-(2-thiophen-2-ylethanoylamino)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
MOLECULAR FORMULA: C17H18N2O6S2
MOLECULAR WEIGHT: 410.46462
SMILES: CC1C(=C(N2C(S1)C(C2=O)NC(=O)CC3=CC=CS3)C(=O)O)COC(=O)C
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Product OPENEYE NAME: 4-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-3-carboxylic acid
CAS Name: 4-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-3-carboxylic acid
IUPAC NAME: 4-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-3-carboxylic acid
SYSTEMATIC NAME: 4-methyl-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-3-carboxylic acid
MOLECULAR FORMULA: C8H9NO3S
MOLECULAR WEIGHT: 199.22696
SMILES: CC1C(=CN2C(S1)CC2=O)C(=O)O
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Product OPENEYE NAME: benzhydryl 3-[(E)-methoxyiminomethyl]-4-methyl-8-oxo-7-[[2-(2-thienyl)acetyl]amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
CAS Name: 3-[(E)-methoxyiminomethyl]-4-methyl-8-oxo-7-[(1-oxo-2-thiophen-2-ylethyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid (diphenylmethyl) ester
IUPAC NAME: benzhydryl 3-[(E)-methoxyiminomethyl]-4-methyl-8-oxo-7-[(2-thiophen-2-ylacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
SYSTEMATIC NAME: (diphenylmethyl) 3-[(E)-methoxyiminomethyl]-4-methyl-8-oxidanylidene-7-(2-thiophen-2-ylethanoylamino)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
MOLECULAR FORMULA: C29H27N3O5S2
MOLECULAR WEIGHT: 561.67178
SMILES: CC1C(=C(N2C(S1)C(C2=O)NC(=O)CC3=CC=CS3)C(=O)OC(C4=CC=CC=C4)C5=CC=CC=C5)/C=N/OC
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Product OPENEYE NAME: (4-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-en-3-yl)methyl acetate
CAS Name: acetic acid (4-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-en-3-yl)methyl ester
IUPAC NAME: (4-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-en-3-yl)methyl acetate
SYSTEMATIC NAME: (4-methyl-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-en-3-yl)methyl ethanoate
MOLECULAR FORMULA: C10H13NO3S
MOLECULAR WEIGHT: 227.28012
SMILES: CC1C(=CN2C(S1)CC2=O)COC(=O)C
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Product OPENEYE NAME: benzhydryl 3-formyl-4-methyl-5,8-dioxo-7-[[2-(2-thienyl)acetyl]amino]-5$l^{4}-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
CAS Name: 3-formyl-4-methyl-5,8-dioxo-7-[(1-oxo-2-thiophen-2-ylethyl)amino]-5$l^{4}-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid (diphenylmethyl) ester
IUPAC NAME: benzhydryl 3-formyl-4-methyl-5,8-dioxo-7-[(2-thiophen-2-ylacetyl)amino]-5$l^{4}-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
SYSTEMATIC NAME: (diphenylmethyl) 3-methanoyl-4-methyl-5,8-bis(oxidanylidene)-7-(2-thiophen-2-ylethanoylamino)-5$l^{4}-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
MOLECULAR FORMULA: C28H24N2O6S2
MOLECULAR WEIGHT: 548.62996
SMILES: CC1C(=C(N2C(S1=O)C(C2=O)NC(=O)CC3=CC=CS3)C(=O)OC(C4=CC=CC=C4)C5=CC=CC=C5)C=O
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Product OPENEYE NAME: benzhydryl 7-[[(2E)-2-[2-[(2-chloroacetyl)amino]thiazol-4-yl]-2-methoxyimino-acetyl]amino]-3-[(E)-methoxyiminomethyl]-4-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
CAS Name: 7-[[(2E)-2-[2-[(2-chloro-1-oxoethyl)amino]-4-thiazolyl]-2-methoxyimino-1-oxoethyl]amino]-3-[(E)-methoxyiminomethyl]-4-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid (diphenylmethyl) ester
IUPAC NAME: benzhydryl 7-[[(2E)-2-[2-[(2-chloroacetyl)amino]-1,3-thiazol-4-yl]-2-methoxyiminoacetyl]amino]-3-[(E)-methoxyiminomethyl]-4-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
SYSTEMATIC NAME: (diphenylmethyl) 7-[[(2E)-2-[2-(2-chloranylethanoylamino)-1,3-thiazol-4-yl]-2-methoxyimino-ethanoyl]amino]-3-[(E)-methoxyiminomethyl]-4-methyl-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
MOLECULAR FORMULA: C31H29ClN6O7S2
MOLECULAR WEIGHT: 697.18096
SMILES: CC1C(=C(N2C(S1)C(C2=O)NC(=O)/C(=N/OC)/C3=CSC(=N3)NC(=O)CCl)C(=O)OC(C4=CC=CC=C4)C5=CC=CC=C5)/C=N/OC
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Product OPENEYE NAME: 4-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-3-carbaldehyde
CAS Name: 4-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-3-carboxaldehyde
IUPAC NAME: 4-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-3-carbaldehyde
SYSTEMATIC NAME: 4-methyl-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-3-carbaldehyde
MOLECULAR FORMULA: C8H9NO2S
MOLECULAR WEIGHT: 183.22756
SMILES: CC1C(=CN2C(S1)CC2=O)C=O
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Product OPENEYE NAME: benzhydryl 3-[(E)-methoxyiminomethyl]-4-methyl-5,8-dioxo-7-[[2-(2-thienyl)acetyl]amino]-5$l^{4}-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
CAS Name: 3-[(E)-methoxyiminomethyl]-4-methyl-5,8-dioxo-7-[(1-oxo-2-thiophen-2-ylethyl)amino]-5$l^{4}-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid (diphenylmethyl) ester
IUPAC NAME: benzhydryl 3-[(E)-methoxyiminomethyl]-4-methyl-5,8-dioxo-7-[(2-thiophen-2-ylacetyl)amino]-5$l^{4}-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
SYSTEMATIC NAME: (diphenylmethyl) 3-[(E)-methoxyiminomethyl]-4-methyl-5,8-bis(oxidanylidene)-7-(2-thiophen-2-ylethanoylamino)-5$l^{4}-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
MOLECULAR FORMULA: C29H27N3O6S2
MOLECULAR WEIGHT: 577.67118
SMILES: CC1C(=C(N2C(S1=O)C(C2=O)NC(=O)CC3=CC=CS3)C(=O)OC(C4=CC=CC=C4)C5=CC=CC=C5)/C=N/OC
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Product OPENEYE NAME: benzhydryl 4-methyl-3-[(E)-1-morpholinoethoxyiminomethyl]-5,8-dioxo-7-[[2-(2-thienyl)acetyl]amino]-5$l^{4}-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
CAS Name: 4-methyl-3-[(E)-1-(4-morpholinyl)ethoxyiminomethyl]-5,8-dioxo-7-[(1-oxo-2-thiophen-2-ylethyl)amino]-5$l^{4}-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid (diphenylmethyl) ester
IUPAC NAME: benzhydryl 4-methyl-3-[(E)-1-morpholin-4-ylethoxyiminomethyl]-5,8-dioxo-7-[(2-thiophen-2-ylacetyl)amino]-5$l^{4}-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
SYSTEMATIC NAME: (diphenylmethyl) 4-methyl-3-[(E)-1-morpholin-4-ylethoxyiminomethyl]-5,8-bis(oxidanylidene)-7-(2-thiophen-2-ylethanoylamino)-5$l^{4}-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
MOLECULAR FORMULA: C34H36N4O7S2
MOLECULAR WEIGHT: 676.80224
SMILES: CC1C(=C(N2C(S1=O)C(C2=O)NC(=O)CC3=CC=CS3)C(=O)OC(C4=CC=CC=C4)C5=CC=CC=C5)/C=N/OC(C)N6CCOCC6
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Product OPENEYE NAME: 7-amino-4-methyl-3-[(1-methyltetrazol-5-yl)sulfanylmethyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
CAS Name: 7-amino-4-methyl-3-[[(1-methyl-5-tetrazolyl)thio]methyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
IUPAC NAME: 7-amino-4-methyl-3-[(1-methyltetrazol-5-yl)sulfanylmethyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
SYSTEMATIC NAME: 7-azanyl-4-methyl-3-[(1-methyl-1,2,3,4-tetrazol-5-yl)sulfanylmethyl]-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
MOLECULAR FORMULA: C11H13N6O3S2-
MOLECULAR WEIGHT: 341.38932
SMILES: CC1C(=C(N2C(S1)C(C2=O)N)C(=O)[O-])CSC3=NN=NN3C
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Product OPENEYE NAME: 7-amino-4-methyl-3-[(1-methyltetrazol-5-yl)sulfanylmethyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
CAS Name: 7-amino-4-methyl-3-[[(1-methyl-5-tetrazolyl)thio]methyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
IUPAC NAME: 7-amino-4-methyl-3-[(1-methyltetrazol-5-yl)sulfanylmethyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
SYSTEMATIC NAME: 7-azanyl-4-methyl-3-[(1-methyl-1,2,3,4-tetrazol-5-yl)sulfanylmethyl]-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
MOLECULAR FORMULA: C11H14N6O3S2
MOLECULAR WEIGHT: 342.39726
SMILES: CC1C(=C(N2C(S1)C(C2=O)N)C(=O)O)CSC3=NN=NN3C
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Product OPENEYE NAME: 3-[(E)-methoxyiminomethyl]-4-methyl-5-thia-1-azabicyclo[4.2.0]oct-2-en-8-one
CAS Name: 3-[(E)-methoxyiminomethyl]-4-methyl-5-thia-1-azabicyclo[4.2.0]oct-2-en-8-one
IUPAC NAME: 3-[(E)-methoxyiminomethyl]-4-methyl-5-thia-1-azabicyclo[4.2.0]oct-2-en-8-one
SYSTEMATIC NAME: 3-[(E)-methoxyiminomethyl]-4-methyl-5-thia-1-azabicyclo[4.2.0]oct-2-en-8-one
MOLECULAR FORMULA: C9H12N2O2S
MOLECULAR WEIGHT: 212.26878
SMILES: CC1C(=CN2C(S1)CC2=O)/C=N/OC
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Product OPENEYE NAME: 4-methyl-5-oxo-5$l^{4}-thia-1-azabicyclo[4.2.0]oct-2-en-8-one
CAS Name: 4-methyl-5-oxo-5$l^{4}-thia-1-azabicyclo[4.2.0]oct-2-en-8-one
IUPAC NAME: 4-methyl-5-oxo-5$l^{4}-thia-1-azabicyclo[4.2.0]oct-2-en-8-one
SYSTEMATIC NAME: 4-methyl-5-oxidanylidene-5$l^{4}-thia-1-azabicyclo[4.2.0]oct-2-en-8-one
MOLECULAR FORMULA: C7H9NO2S
MOLECULAR WEIGHT: 171.21686
SMILES: CC1C=CN2C(S1=O)CC2=O
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Product OPENEYE NAME: 3-[[1-(carboxymethyl)tetrazol-5-yl]sulfanylmethyl]-4-methyl-8-oxo-7-[[2-(2-thienyl)acetyl]amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
CAS Name: 3-[[[1-(carboxymethyl)-5-tetrazolyl]thio]methyl]-4-methyl-8-oxo-7-[(1-oxo-2-thiophen-2-ylethyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
IUPAC NAME: 3-[[1-(carboxymethyl)tetrazol-5-yl]sulfanylmethyl]-4-methyl-8-oxo-7-[(2-thiophen-2-ylacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
SYSTEMATIC NAME: 3-[[1-(2-hydroxy-2-oxoethyl)-1,2,3,4-tetrazol-5-yl]sulfanylmethyl]-4-methyl-8-oxidanylidene-7-(2-thiophen-2-ylethanoylamino)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
MOLECULAR FORMULA: C18H18N6O6S3
MOLECULAR WEIGHT: 510.56712
SMILES: CC1C(=C(N2C(S1)C(C2=O)NC(=O)CC3=CC=CS3)C(=O)O)CSC4=NN=NN4CC(=O)O
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Product OPENEYE NAME: 3-methyl-4-methylene-5-thia-1-azabicyclo[4.2.0]oct-2-en-8-one
CAS Name: 3-methyl-4-methylene-5-thia-1-azabicyclo[4.2.0]oct-2-en-8-one
IUPAC NAME: 3-methyl-4-methylidene-5-thia-1-azabicyclo[4.2.0]oct-2-en-8-one
SYSTEMATIC NAME: 3-methyl-4-methylidene-5-thia-1-azabicyclo[4.2.0]oct-2-en-8-one
MOLECULAR FORMULA: C8H9NOS
MOLECULAR WEIGHT: 167.22816
SMILES: CC1=CN2C(CC2=O)SC1=C
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Product OPENEYE NAME: benzhydryl 3-(acetoxymethyl)-7-[[(2E)-2-[2-[(2-chloroacetyl)amino]thiazol-4-yl]-2-methoxyimino-acetyl]amino]-4-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
CAS Name: 3-(acetyloxymethyl)-7-[[(2E)-2-[2-[(2-chloro-1-oxoethyl)amino]-4-thiazolyl]-2-methoxyimino-1-oxoethyl]amino]-4-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid (diphenylmethyl) ester
IUPAC NAME: benzhydryl 3-(acetyloxymethyl)-7-[[(2E)-2-[2-[(2-chloroacetyl)amino]-1,3-thiazol-4-yl]-2-methoxyiminoacetyl]amino]-4-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
SYSTEMATIC NAME: (diphenylmethyl) 3-(acetyloxymethyl)-7-[[(2E)-2-[2-(2-chloranylethanoylamino)-1,3-thiazol-4-yl]-2-methoxyimino-ethanoyl]amino]-4-methyl-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
MOLECULAR FORMULA: C32H30ClN5O8S2
MOLECULAR WEIGHT: 712.1923
SMILES: CC1C(=C(N2C(S1)C(C2=O)NC(=O)/C(=N/OC)/C3=CSC(=N3)NC(=O)CCl)C(=O)OC(C4=CC=CC=C4)C5=CC=CC=C5)COC(=O)C
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Product OPENEYE NAME: 7-[[(2E)-2-(2-aminothiazol-4-yl)-2-methoxyimino-acetyl]amino]-4-methyl-3-[(1-methyltetrazol-5-yl)sulfanylmethyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
CAS Name: 7-[[(2E)-2-(2-amino-4-thiazolyl)-2-methoxyimino-1-oxoethyl]amino]-4-methyl-3-[[(1-methyl-5-tetrazolyl)thio]methyl]-8-oxo-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-methoxyiminoacetyl]amino]-4-methyl-3-[(1-methyltetrazol-5-yl)sulfanylmethyl]-8-oxo-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-methoxyimino-ethanoyl]amino]-4-methyl-3-[(1-methyl-1,2,3,4-tetrazol-5-yl)sulfanylmethyl]-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
MOLECULAR FORMULA: C17H19N9O5S3
MOLECULAR WEIGHT: 525.58506
SMILES: CC1C(=C(N2C(S1)C(C2=O)NC(=O)/C(=N/OC)/C3=CSC(=N3)N)C(=O)O)CSC4=NN=NN4C
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Product OPENEYE NAME: 3-methoxy-5-thia-1-azabicyclo[4.2.0]oct-2-ene-4,8-dione
CAS Name: 3-methoxy-5-thia-1-azabicyclo[4.2.0]oct-2-ene-4,8-dione
IUPAC NAME: 3-methoxy-5-thia-1-azabicyclo[4.2.0]oct-2-ene-4,8-dione
SYSTEMATIC NAME: 3-methoxy-5-thia-1-azabicyclo[4.2.0]oct-2-ene-4,8-dione
MOLECULAR FORMULA: C7H7NO3S
MOLECULAR WEIGHT: 185.20038
SMILES: COC1=CN2C(CC2=O)SC1=O
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Product OPENEYE NAME: 4-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-3-carbonitrile
CAS Name: 4-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-3-carbonitrile
IUPAC NAME: 4-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-3-carbonitrile
SYSTEMATIC NAME: 4-methyl-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-3-carbonitrile
MOLECULAR FORMULA: C8H8N2OS
MOLECULAR WEIGHT: 180.22692
SMILES: CC1C(=CN2C(S1)CC2=O)C#N
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