N-[(2-chlorophenyl)methylcarbamothioyl]octanamide

Systemtic Name: N-[(2-chlorophenyl)methylcarbamothioyl]octanamide Openeye Name: N-[(2-chlorophenyl)methylcarbamothioyl]octanamide CAS Name: N-[[(2-chlorophenyl)methylamino]-sulfanylidenemethyl]octanamide IUPAC Name: N-[(2-chlorophenyl)methylcarbamothioyl]octanamide Traditional Name: N-[(2-chlorobenzyl)thiocarbamoyl]caprylamide Formula: C16H23ClN2OS MolecularWeight: 326.88462

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)NC(=S)NCC1=CC=CC=C1Cl

Isomeric SMILES

CCCCCCCC(=O)NC(=S)NCC1=CC=CC=C1Cl

InChI

InChI=1S/C16H23ClN2OS/c1-2-3-4-5-6-11-15(20)19-16(21)18-12-13-9-7-8-10-14(13)17/h7-10H,2-6,11-12H2,1H3,(H2,18,19,20,21)