(diphenylmethyl) 8-oxidanylidene-7-(2-phenylethanoylamino)-3-pyridin-3-ylsulfonyloxy-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

Systemtic Name: (diphenylmethyl) 8-oxidanylidene-7-(2-phenylethanoylamino)-3-pyridin-3-ylsulfonyloxy-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Openeye Name: benzhydryl 8-oxo-7-[(2-phenylacetyl)amino]-3-(3-pyridylsulfonyloxy)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate CAS Name: 8-oxo-7-[(1-oxo-2-phenylethyl)amino]-3-(3-pyridinylsulfonyloxy)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid (diphenylmethyl) ester IUPAC Name: benzhydryl 8-oxo-7-[(2-phenylacetyl)amino]-3-pyridin-3-ylsulfonyloxy-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Traditional Name: 8-keto-7-[(2-phenylacetyl)amino]-3-(3-pyridylsulfonyloxy)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid benzhydryl ester Formula: C33H27N3O7S2 MolecularWeight: 641.71338

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=C(N2C(S1)C(C2=O)NC(=O)CC3=CC=CC=C3)C(=O)OC(C4=CC=CC=C4)C5=CC=CC=C5)OS(=O)(=O)C6=CN=CC=C6

Isomeric SMILES

C1C(=C(N2C(S1)C(C2=O)NC(=O)CC3=CC=CC=C3)C(=O)OC(C4=CC=CC=C4)C5=CC=CC=C5)OS(=O)(=O)C6=CN=CC=C6

InChI

InChI=1S/C33H27N3O7S2/c37-27(19-22-11-4-1-5-12-22)35-28-31(38)36-29(26(21-44-32(28)36)43-45(40,41)25-17-10-18-34-20-25)33(39)42-30(23-13-6-2-7-14-23)24-15-8-3-9-16-24/h1-18,20,28,30,32H,19,21H2,(H,35,37)