N-[[4-(2-methylpiperidin-1-yl)phenyl]carbamothioyl]pentanamide

Systemtic Name: N-[[4-(2-methylpiperidin-1-yl)phenyl]carbamothioyl]pentanamide Openeye Name: N-[[4-(2-methyl-1-piperidyl)phenyl]carbamothioyl]pentanamide CAS Name: N-[[4-(2-methyl-1-piperidinyl)anilino]-sulfanylidenemethyl]pentanamide IUPAC Name: N-[[4-(2-methylpiperidin-1-yl)phenyl]carbamothioyl]pentanamide Traditional Name: N-[[4-(2-methylpiperidino)phenyl]thiocarbamoyl]valeramide Formula: C18H27N3OS MolecularWeight: 333.49148

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC(=S)NC1=CC=C(C=C1)N2CCCCC2C

Isomeric SMILES

CCCCC(=O)NC(=S)NC1=CC=C(C=C1)N2CCCCC2C

InChI

InChI=1S/C18H27N3OS/c1-3-4-8-17(22)20-18(23)19-15-9-11-16(12-10-15)21-13-6-5-7-14(21)2/h9-12,14H,3-8,13H2,1-2H3,(H2,19,20,22,23)