1-(1H-benzimidazol-2-yl)-N-[2-(4-methylsulfanylphenyl)ethyl]piperidine-4-carboxamide

Systemtic Name: 1-(1H-benzimidazol-2-yl)-N-[2-(4-methylsulfanylphenyl)ethyl]piperidine-4-carboxamide Openeye Name: 1-(1H-benzimidazol-2-yl)-N-[2-(4-methylsulfanylphenyl)ethyl]piperidine-4-carboxamide CAS Name: 1-(1H-benzimidazol-2-yl)-N-[2-[4-(methylthio)phenyl]ethyl]-4-piperidinecarboxamide IUPAC Name: 1-(1H-benzimidazol-2-yl)-N-[2-(4-methylsulfanylphenyl)ethyl]piperidine-4-carboxamide Traditional Name: 1-(1H-benzimidazol-2-yl)-N-[2-[4-(methylthio)phenyl]ethyl]isonipecotamide Formula: C22H26N4OS MolecularWeight: 394.53304

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)CCNC(=O)C2CCN(CC2)C3=NC4=CC=CC=C4N3

Isomeric SMILES

CSC1=CC=C(C=C1)CCNC(=O)C2CCN(CC2)C3=NC4=CC=CC=C4N3

InChI

InChI=1S/C22H26N4OS/c1-28-18-8-6-16(7-9-18)10-13-23-21(27)17-11-14-26(15-12-17)22-24-19-4-2-3-5-20(19)25-22/h2-9,17H,10-15H2,1H3,(H,23,27)(H,24,25)