N-[(3-chloranyl-2-piperidin-1-yl-phenyl)carbamothioyl]butanamide

Systemtic Name: N-[(3-chloranyl-2-piperidin-1-yl-phenyl)carbamothioyl]butanamide Openeye Name: N-[[3-chloro-2-(1-piperidyl)phenyl]carbamothioyl]butanamide CAS Name: N-[[3-chloro-2-(1-piperidinyl)anilino]-sulfanylidenemethyl]butanamide IUPAC Name: N-[(3-chloro-2-piperidin-1-ylphenyl)carbamothioyl]butanamide Traditional Name: N-[(3-chloro-2-piperidino-phenyl)thiocarbamoyl]butyramide Formula: C16H22ClN3OS MolecularWeight: 339.88338

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC(=S)NC1=C(C(=CC=C1)Cl)N2CCCCC2

Isomeric SMILES

CCCC(=O)NC(=S)NC1=C(C(=CC=C1)Cl)N2CCCCC2

InChI

InChI=1S/C16H22ClN3OS/c1-2-7-14(21)19-16(22)18-13-9-6-8-12(17)15(13)20-10-4-3-5-11-20/h6,8-9H,2-5,7,10-11H2,1H3,(H2,18,19,21,22)