1-[2-tert-butyl-4-[(4-chlorophenyl)-pyridin-2-yl-methyl]piperazin-1-yl]-2-piperidin-4-yl-ethanone

Systemtic Name: 1-[2-tert-butyl-4-[(4-chlorophenyl)-pyridin-2-yl-methyl]piperazin-1-yl]-2-piperidin-4-yl-ethanone Openeye Name: 1-[2-tert-butyl-4-[(4-chlorophenyl)-(2-pyridyl)methyl]piperazin-1-yl]-2-(4-piperidyl)ethanone CAS Name: 1-[2-tert-butyl-4-[(4-chlorophenyl)-(2-pyridinyl)methyl]-1-piperazinyl]-2-(4-piperidinyl)ethanone IUPAC Name: 1-[2-tert-butyl-4-[(4-chlorophenyl)-pyridin-2-ylmethyl]piperazin-1-yl]-2-piperidin-4-ylethanone Traditional Name: 1-[2-tert-butyl-4-[(4-chlorophenyl)-(2-pyridyl)methyl]piperazino]-2-(4-piperidyl)ethanone Formula: C27H37ClN4O MolecularWeight: 469.06188

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CN(CCN1C(=O)CC2CCNCC2)C(C3=CC=C(C=C3)Cl)C4=CC=CC=N4

Isomeric SMILES

CC(C)(C)C1CN(CCN1C(=O)CC2CCNCC2)C(C3=CC=C(C=C3)Cl)C4=CC=CC=N4

InChI

InChI=1S/C27H37ClN4O/c1-27(2,3)24-19-31(16-17-32(24)25(33)18-20-11-14-29-15-12-20)26(23-6-4-5-13-30-23)21-7-9-22(28)10-8-21/h4-10,13,20,24,26,29H,11-12,14-19H2,1-3H3