(phenylmethyl) 4-oxidanylidene-1-[(phenylmethyl)carbamothioyl]azetidine-2-carboxylate

Systemtic Name: (phenylmethyl) 4-oxidanylidene-1-[(phenylmethyl)carbamothioyl]azetidine-2-carboxylate Openeye Name: benzyl 1-(benzylcarbamothioyl)-4-oxo-azetidine-2-carboxylate CAS Name: 4-oxo-1-[[(phenylmethyl)amino]-sulfanylidenemethyl]-2-azetidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 1-(benzylcarbamothioyl)-4-oxoazetidine-2-carboxylate Traditional Name: 1-(benzylthiocarbamoyl)-4-keto-azetidine-2-carboxylic acid benzyl ester Formula: C19H18N2O3S MolecularWeight: 354.42282

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(C1=O)C(=S)NCC2=CC=CC=C2)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

C1C(N(C1=O)C(=S)NCC2=CC=CC=C2)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C19H18N2O3S/c22-17-11-16(18(23)24-13-15-9-5-2-6-10-15)21(17)19(25)20-12-14-7-3-1-4-8-14/h1-10,16H,11-13H2,(H,20,25)