7-oxidanylidene-3,6-bis(phenylmethyl)-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate

Systemtic Name: 7-oxidanylidene-3,6-bis(phenylmethyl)-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Openeye Name: 3,6-dibenzyl-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate CAS Name: 7-oxo-3,6-bis(phenylmethyl)-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate IUPAC Name: 3,6-dibenzyl-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Traditional Name: 3,6-dibenzyl-7-keto-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Formula: C20H16NO3S- MolecularWeight: 350.41094

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2C3N(C2=O)C(=C(S3)CC4=CC=CC=C4)C(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CC2C3N(C2=O)C(=C(S3)CC4=CC=CC=C4)C(=O)[O-]

InChI

InChI=1S/C20H17NO3S/c22-18-15(11-13-7-3-1-4-8-13)19-21(18)17(20(23)24)16(25-19)12-14-9-5-2-6-10-14/h1-10,15,19H,11-12H2,(H,23,24)/p-1