N-[(3-piperidin-1-ylcarbonylphenyl)carbamothioyl]octanamide

Systemtic Name: N-[(3-piperidin-1-ylcarbonylphenyl)carbamothioyl]octanamide Openeye Name: N-[[3-(piperidine-1-carbonyl)phenyl]carbamothioyl]octanamide CAS Name: N-[[3-[oxo(1-piperidinyl)methyl]anilino]-sulfanylidenemethyl]octanamide IUPAC Name: N-[[3-(piperidine-1-carbonyl)phenyl]carbamothioyl]octanamide Traditional Name: N-[[3-(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(=C1)C(=O)N2CCCCC2

Isomeric SMILES

CCCCCCCC(=O)NC(=S)NC1=CC=CC(=C1)C(=O)N2CCCCC2

InChI

InChI=1S/C21H31N3O2S/c1-2-3-4-5-7-13-19(25)23-21(27)22-18-12-10-11-17(16-18)20(26)24-14-8-6-9-15-24/h10-12,16H,2-9,13-15H2,1H3,(H2,22,23,25,27)