N-[(4-methylphenyl)methylcarbamothioyl]octanamide

Systemtic Name: N-[(4-methylphenyl)methylcarbamothioyl]octanamide Openeye Name: N-(p-tolylmethylcarbamothioyl)octanamide CAS Name: N-[[(4-methylphenyl)methylamino]-sulfanylidenemethyl]octanamide IUPAC Name: N-[(4-methylphenyl)methylcarbamothioyl]octanamide Traditional Name: N-[(4-methylbenzyl)thiocarbamoyl]caprylamide Formula: C17H26N2OS MolecularWeight: 306.46614

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)NC(=S)NCC1=CC=C(C=C1)C

Isomeric SMILES

CCCCCCCC(=O)NC(=S)NCC1=CC=C(C=C1)C

InChI

InChI=1S/C17H26N2OS/c1-3-4-5-6-7-8-16(20)19-17(21)18-13-15-11-9-14(2)10-12-15/h9-12H,3-8,13H2,1-2H3,(H2,18,19,20,21)