2-[2-[(2-chlorophenyl)methylsulfanyl]benzimidazol-1-yl]-1-piperidin-1-yl-ethanone

Systemtic Name: 2-[2-[(2-chlorophenyl)methylsulfanyl]benzimidazol-1-yl]-1-piperidin-1-yl-ethanone Openeye Name: 2-[2-[(2-chlorophenyl)methylsulfanyl]benzimidazol-1-yl]-1-(1-piperidyl)ethanone CAS Name: 2-[2-[(2-chlorophenyl)methylthio]-1-benzimidazolyl]-1-(1-piperidinyl)ethanone IUPAC Name: 2-[2-[(2-chlorophenyl)methylsulfanyl]benzimidazol-1-yl]-1-piperidin-1-ylethanone Traditional Name: 2-[2-[(2-chlorobenzyl)thio]benzimidazol-1-yl]-1-piperidino-ethanone Formula: C21H22ClN3OS MolecularWeight: 399.93688

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)CN2C3=CC=CC=C3N=C2SCC4=CC=CC=C4Cl

Isomeric SMILES

C1CCN(CC1)C(=O)CN2C3=CC=CC=C3N=C2SCC4=CC=CC=C4Cl

InChI

InChI=1S/C21H22ClN3OS/c22-17-9-3-2-8-16(17)15-27-21-23-18-10-4-5-11-19(18)25(21)14-20(26)24-12-6-1-7-13-24/h2-5,8-11H,1,6-7,12-15H2