2-(cyanomethylsulfanyl)-N-[1-(phenylmethyl)piperidin-4-yl]benzamide

Systemtic Name: 2-(cyanomethylsulfanyl)-N-[1-(phenylmethyl)piperidin-4-yl]benzamide Openeye Name: N-(1-benzyl-4-piperidyl)-2-(cyanomethylsulfanyl)benzamide CAS Name: 2-(cyanomethylthio)-N-[1-(phenylmethyl)-4-piperidinyl]benzamide IUPAC Name: N-(1-benzylpiperidin-4-yl)-2-(cyanomethylsulfanyl)benzamide Traditional Name: N-(1-benzyl-4-piperidyl)-2-(cyanomethylthio)benzamide Formula: C21H23N3OS MolecularWeight: 365.49182

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NC(=O)C2=CC=CC=C2SCC#N)CC3=CC=CC=C3

Isomeric SMILES

C1CN(CCC1NC(=O)C2=CC=CC=C2SCC#N)CC3=CC=CC=C3

InChI

InChI=1S/C21H23N3OS/c22-12-15-26-20-9-5-4-8-19(20)21(25)23-18-10-13-24(14-11-18)16-17-6-2-1-3-7-17/h1-9,18H,10-11,13-16H2,(H,23,25)