3-methyl-N-[(2-piperidin-1-ylphenyl)carbamothioyl]butanamide

Systemtic Name: 3-methyl-N-[(2-piperidin-1-ylphenyl)carbamothioyl]butanamide Openeye Name: 3-methyl-N-[[2-(1-piperidyl)phenyl]carbamothioyl]butanamide CAS Name: 3-methyl-N-[[2-(1-piperidinyl)anilino]-sulfanylidenemethyl]butanamide IUPAC Name: 3-methyl-N-[(2-piperidin-1-ylphenyl)carbamothioyl]butanamide Traditional Name: 3-methyl-N-[(2-piperidinophenyl)thiocarbamoyl]butyramide Formula: C17H25N3OS MolecularWeight: 319.4649

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NC(=S)NC1=CC=CC=C1N2CCCCC2

Isomeric SMILES

CC(C)CC(=O)NC(=S)NC1=CC=CC=C1N2CCCCC2

InChI

InChI=1S/C17H25N3OS/c1-13(2)12-16(21)19-17(22)18-14-8-4-5-9-15(14)20-10-6-3-7-11-20/h4-5,8-9,13H,3,6-7,10-12H2,1-2H3,(H2,18,19,21,22)