(diphenylmethyl) 3-methyl-2-(7-oxidanylidene-3-phenyl-4-oxa-2,6-diazabicyclo[3.2.0]hept-2-en-6-yl)-3-sulfanyl-butanoate

Systemtic Name: (diphenylmethyl) 3-methyl-2-(7-oxidanylidene-3-phenyl-4-oxa-2,6-diazabicyclo[3.2.0]hept-2-en-6-yl)-3-sulfanyl-butanoate Openeye Name: benzhydryl 3-methyl-2-(7-oxo-3-phenyl-4-oxa-2,6-diazabicyclo[3.2.0]hept-2-en-6-yl)-3-sulfanyl-butanoate CAS Name: 3-mercapto-3-methyl-2-(7-oxo-3-phenyl-4-oxa-2,6-diazabicyclo[3.2.0]hept-2-en-6-yl)butanoic acid (diphenylmethyl) ester IUPAC Name: benzhydryl 3-methyl-2-(7-oxo-3-phenyl-4-oxa-2,6-diazabicyclo[3.2.0]hept-2-en-6-yl)-3-sulfanylbutanoate Traditional Name: 2-(7-keto-3-phenyl-4-oxa-2,6-diazabicyclo[3.2.0]hept-2-en-6-yl)-3-mercapto-3-methyl-butyric acid benzhydryl ester Formula: C28H26N2O4S MolecularWeight: 486.58204

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(C(=O)OC(C1=CC=CC=C1)C2=CC=CC=C2)N3C4C(C3=O)N=C(O4)C5=CC=CC=C5)S

Isomeric SMILES

CC(C)(C(C(=O)OC(C1=CC=CC=C1)C2=CC=CC=C2)N3C4C(C3=O)N=C(O4)C5=CC=CC=C5)S

InChI

InChI=1S/C28H26N2O4S/c1-28(2,35)23(30-25(31)21-26(30)34-24(29-21)20-16-10-5-11-17-20)27(32)33-22(18-12-6-3-7-13-18)19-14-8-4-9-15-19/h3-17,21-23,26,35H,1-2H3