N-[[3-[ethanoyl(methyl)amino]phenyl]carbamothioyl]octanamide

Systemtic Name: N-[[3-[ethanoyl(methyl)amino]phenyl]carbamothioyl]octanamide Openeye Name: N-[[3-[acetyl(methyl)amino]phenyl]carbamothioyl]octanamide CAS Name: N-[[3-[acetyl(methyl)amino]anilino]-sulfanylidenemethyl]octanamide IUPAC Name: N-[[3-[acetyl(methyl)amino]phenyl]carbamothioyl]octanamide Traditional Name: N-[[3-[acetyl(methyl)amino]phenyl]thiocarbamoyl]caprylamide Formula: C18H27N3O2S MolecularWeight: 349.49088

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)NC(=S)NC1=CC(=CC=C1)N(C)C(=O)C

Isomeric SMILES

CCCCCCCC(=O)NC(=S)NC1=CC(=CC=C1)N(C)C(=O)C

InChI

InChI=1S/C18H27N3O2S/c1-4-5-6-7-8-12-17(23)20-18(24)19-15-10-9-11-16(13-15)21(3)14(2)22/h9-11,13H,4-8,12H2,1-3H3,(H2,19,20,23,24)