N-[(2-piperidin-1-ylcarbonylphenyl)carbamothioyl]octanamide

Systemtic Name: N-[(2-piperidin-1-ylcarbonylphenyl)carbamothioyl]octanamide Openeye Name: N-[[2-(piperidine-1-carbonyl)phenyl]carbamothioyl]octanamide CAS Name: N-[[2-[oxo(1-piperidinyl)methyl]anilino]-sulfanylidenemethyl]octanamide IUPAC Name: N-[[2-(piperidine-1-carbonyl)phenyl]carbamothioyl]octanamide Traditional Name: N-[[2-(piperidine-1-carbonyl)phenyl]thiocarbamoyl]caprylamide Formula: C21H31N3O2S MolecularWeight: 389.55474

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)NC(=S)NC1=CC=CC=C1C(=O)N2CCCCC2

Isomeric SMILES

CCCCCCCC(=O)NC(=S)NC1=CC=CC=C1C(=O)N2CCCCC2

InChI

InChI=1S/C21H31N3O2S/c1-2-3-4-5-7-14-19(25)23-21(27)22-18-13-9-8-12-17(18)20(26)24-15-10-6-11-16-24/h8-9,12-13H,2-7,10-11,14-16H2,1H3,(H2,22,23,25,27)