S-(phenylmethyl) N-(1-oxidanylidene-3-phenyl-propan-2-yl)carbamothioate

Systemtic Name: S-(phenylmethyl) N-(1-oxidanylidene-3-phenyl-propan-2-yl)carbamothioate Openeye Name: S-benzyl N-(1-benzyl-2-oxo-ethyl)carbamothioate CAS Name: N-(1-oxo-3-phenylpropan-2-yl)carbamothioic acid S-(phenylmethyl) ester IUPAC Name: S-benzyl N-(1-oxo-3-phenylpropan-2-yl)carbamothioate Traditional Name: N-(1-benzyl-2-keto-ethyl)thiocarbamic acid S-benzyl ester Formula: C17H17NO2S MolecularWeight: 299.38738

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C=O)NC(=O)SCC2=CC=CC=C2

Isomeric SMILES

C1=CC=C(C=C1)CC(C=O)NC(=O)SCC2=CC=CC=C2

InChI

InChI=1S/C17H17NO2S/c19-12-16(11-14-7-3-1-4-8-14)18-17(20)21-13-15-9-5-2-6-10-15/h1-10,12,16H,11,13H2,(H,18,20)