(diphenylmethyl) 7-(4-acetamido-1H-benzimidazol-2-yl)-3-methyl-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

Systemtic Name: (diphenylmethyl) 7-(4-acetamido-1H-benzimidazol-2-yl)-3-methyl-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Openeye Name: benzhydryl 7-(4-acetamido-1H-benzimidazol-2-yl)-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate CAS Name: 7-(4-acetamido-1H-benzimidazol-2-yl)-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid (diphenylmethyl) ester IUPAC Name: benzhydryl 7-(4-acetamido-1H-benzimidazol-2-yl)-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Traditional Name: 7-(4-acetamido-1H-benzimidazol-2-yl)-8-keto-3-methyl-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid benzhydryl ester Formula: C30H26N4O4S MolecularWeight: 538.61684

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N2C(C(C2=O)C3=NC4=C(N3)C=CC=C4NC(=O)C)SC1)C(=O)OC(C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

CC1=C(N2C(C(C2=O)C3=NC4=C(N3)C=CC=C4NC(=O)C)SC1)C(=O)OC(C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C30H26N4O4S/c1-17-16-39-29-23(27-32-22-15-9-14-21(24(22)33-27)31-18(2)35)28(36)34(29)25(17)30(37)38-26(19-10-5-3-6-11-19)20-12-7-4-8-13-20/h3-15,23,26,29H,16H2,1-2H3,(H,31,35)(H,32,33)