N-[[4-[2-(methylamino)-2-oxidanylidene-ethyl]phenyl]carbamothioyl]octanamide

Systemtic Name: N-[[4-[2-(methylamino)-2-oxidanylidene-ethyl]phenyl]carbamothioyl]octanamide Openeye Name: N-[[4-[2-(methylamino)-2-oxo-ethyl]phenyl]carbamothioyl]octanamide CAS Name: N-[[4-[2-(methylamino)-2-oxoethyl]anilino]-sulfanylidenemethyl]octanamide IUPAC Name: N-[[4-[2-(methylamino)-2-oxoethyl]phenyl]carbamothioyl]octanamide Traditional Name: N-[[4-[2-keto-2-(methylamino)ethyl]phenyl]thiocarbamoyl]caprylamide Formula: C18H27N3O2S MolecularWeight: 349.49088

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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