N-[(phenylmethyl)carbamothioyl]butanamide

Systemtic Name: N-[(phenylmethyl)carbamothioyl]butanamide Openeye Name: N-(benzylcarbamothioyl)butanamide CAS Name: N-[[(phenylmethyl)amino]-sulfanylidenemethyl]butanamide IUPAC Name: N-(benzylcarbamothioyl)butanamide Traditional Name: N-(benzylthiocarbamoyl)butyramide Formula: C12H16N2OS MolecularWeight: 236.33324

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC(=S)NCC1=CC=CC=C1

Isomeric SMILES

CCCC(=O)NC(=S)NCC1=CC=CC=C1

InChI

InChI=1S/C12H16N2OS/c1-2-6-11(15)14-12(16)13-9-10-7-4-3-5-8-10/h3-5,7-8H,2,6,9H2,1H3,(H2,13,14,15,16)