[7-[(E)-[(Z)-2-chloranyl-3-phenyl-prop-2-enylidene]amino]-7-(methoxyamino)-3-[(1-methyl-1,2,3,4-tetrazol-5-yl)sulfanylmethyl]-8-oxidanylidene-4,4-diphenyl-5-thia-1-azabicyclo[4.2.0]oct-2-en-2-yl] methyl carbonate

Systemtic Name: [7-[(E)-[(Z)-2-chloranyl-3-phenyl-prop-2-enylidene]amino]-7-(methoxyamino)-3-[(1-methyl-1,2,3,4-tetrazol-5-yl)sulfanylmethyl]-8-oxidanylidene-4,4-diphenyl-5-thia-1-azabicyclo[4.2.0]oct-2-en-2-yl] methyl carbonate Openeye Name: [7-[(E)-[(Z)-2-chloro-3-phenyl-prop-2-enylidene]amino]-7-(methoxyamino)-3-[(1-methyltetrazol-5-yl)sulfanylmethyl]-8-oxo-4,4-diphenyl-5-thia-1-azabicyclo[4.2.0]oct-2-en-2-yl] methyl carbonate CAS Name: carbonic acid [7-[(E)-[(Z)-2-chloro-3-phenylprop-2-enylidene]amino]-7-(methoxyamino)-3-[[(1-methyl-5-tetrazolyl)thio]methyl]-8-oxo-4,4-diphenyl-5-thia-1-azabicyclo[4.2.0]oct-2-en-2-yl] methyl ester IUPAC Name: [7-[(E)-[(Z)-2-chloro-3-phenylprop-2-enylidene]amino]-7-(methoxyamino)-3-[(1-methyltetrazol-5-yl)sulfanylmethyl]-8-oxo-4,4-diphenyl-5-thia-1-azabicyclo[4.2.0]oct-2-en-2-yl] methyl carbonate Traditional Name: carbonic acid [7-[(E)-[(Z)-2-chloro-3-phenyl-prop-2-enylidene]amino]-8-keto-7-(methoxyamino)-3-[[(1-methyltetrazol-5-yl)thio]methyl]-4,4-diphenyl-5-thia-1-azabicyclo[4.2.0]oct-2-en-2-yl] methyl ester Formula: C33H30ClN7O5S2 MolecularWeight: 704.2182

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=N1)SCC2=C(N3C(C(C3=O)(NOC)N=CC(=CC4=CC=CC=C4)Cl)SC2(C5=CC=CC=C5)C6=CC=CC=C6)OC(=O)OC

Isomeric SMILES

CN1C(=NN=N1)SCC2=C(N3C(C(C3=O)(NOC)/N=C/C(=C/C4=CC=CC=C4)/Cl)SC2(C5=CC=CC=C5)C6=CC=CC=C6)OC(=O)OC

InChI

InChI=1S/C33H30ClN7O5S2/c1-40-30(36-38-39-40)47-21-26-27(46-31(43)44-2)41-28(42)33(37-45-3,35-20-25(34)19-22-13-7-4-8-14-22)29(41)48-32(26,23-15-9-5-10-16-23)24-17-11-6-12-18-24/h4-20,29,37H,21H2,1-3H3/b25-19-,35-20+