(phenylmethyl) N-[phenyl-[(phenylmethyl)carbamothioyl]amino]carbamate

Systemtic Name: (phenylmethyl) N-[phenyl-[(phenylmethyl)carbamothioyl]amino]carbamate Openeye Name: benzyl N-[N-(benzylcarbamothioyl)anilino]carbamate CAS Name: N-(N-[[(phenylmethyl)amino]-sulfanylidenemethyl]anilino)carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[N-(benzylcarbamothioyl)anilino]carbamate Traditional Name: N-[N-(benzylthiocarbamoyl)anilino]carbamic acid benzyl ester Formula: C22H21N3O2S MolecularWeight: 391.48604

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=S)N(C2=CC=CC=C2)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)CNC(=S)N(C2=CC=CC=C2)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C22H21N3O2S/c26-22(27-17-19-12-6-2-7-13-19)24-25(20-14-8-3-9-15-20)21(28)23-16-18-10-4-1-5-11-18/h1-15H,16-17H2,(H,23,28)(H,24,26)