(diphenylmethyl) 3-[(E)-C-(4-methylphenyl)sulfonylcarbonohydrazonoyl]-8-oxidanylidene-7-(2-thiophen-2-ylethanoylamino)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

Systemtic Name: (diphenylmethyl) 3-[(E)-C-(4-methylphenyl)sulfonylcarbonohydrazonoyl]-8-oxidanylidene-7-(2-thiophen-2-ylethanoylamino)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Openeye Name: benzhydryl 8-oxo-3-[(E)-p-tolylsulfonylcarbonohydrazonoyl]-7-[[2-(2-thienyl)acetyl]amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate CAS Name: 3-[(E)-hydrazinylidene-(4-methylphenyl)sulfonylmethyl]-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)-C-(4-methylphenyl)sulfonylcarbonohydrazonoyl]-8-oxo-7-[(2-thiophen-2-ylacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Traditional Name: 8-keto-7-[[2-(2-thienyl)acetyl]amino]-3-[(E)-tosylcarbohydrazonoyl]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid benzhydryl ester Formula: C34H30N4O6S3 MolecularWeight: 686.8202

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C(=NN)C2=C(N3C(C(C3=O)NC(=O)CC4=CC=CS4)SC2)C(=O)OC(C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)/C(=N/N)/C2=C(N3C(C(C3=O)NC(=O)CC4=CC=CS4)SC2)C(=O)OC(C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C34H30N4O6S3/c1-21-14-16-25(17-15-21)47(42,43)31(37-35)26-20-46-33-28(36-27(39)19-24-13-8-18-45-24)32(40)38(33)29(26)34(41)44-30(22-9-4-2-5-10-22)23-11-6-3-7-12-23/h2-18,28,30,33H,19-20,35H2,1H3,(H,36,39)/b37-31+