(diphenylmethyl) 7-azanyl-3-[(E)-3-azanyl-3-oxidanylidene-prop-1-enyl]sulfanyl-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

Systemtic Name: (diphenylmethyl) 7-azanyl-3-[(E)-3-azanyl-3-oxidanylidene-prop-1-enyl]sulfanyl-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Openeye Name: benzhydryl 7-amino-3-[(E)-3-amino-3-oxo-prop-1-enyl]sulfanyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate CAS Name: 7-amino-3-[[(E)-3-amino-3-oxoprop-1-enyl]thio]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid (diphenylmethyl) ester IUPAC Name: benzhydryl 7-amino-3-[(E)-3-amino-3-oxoprop-1-enyl]sulfanyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Traditional Name: 7-amino-3-[[(E)-3-amino-3-keto-prop-1-enyl]thio]-8-keto-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid benzhydryl ester Formula: C23H21N3O4S2 MolecularWeight: 467.56054

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=C(N2C(S1)C(C2=O)N)C(=O)OC(C3=CC=CC=C3)C4=CC=CC=C4)SC=CC(=O)N

Isomeric SMILES

C1C(=C(N2C(S1)C(C2=O)N)C(=O)OC(C3=CC=CC=C3)C4=CC=CC=C4)S/C=C/C(=O)N

InChI

InChI=1S/C23H21N3O4S2/c24-17(27)11-12-31-16-13-32-22-18(25)21(28)26(22)19(16)23(29)30-20(14-7-3-1-4-8-14)15-9-5-2-6-10-15/h1-12,18,20,22H,13,25H2,(H2,24,27)/b12-11+