1-[2-tert-butyl-4-[[5-(3,4-dichlorophenyl)pyridin-2-yl]methyl]piperazin-1-yl]-2-piperidin-4-yl-ethanone

Systemtic Name: 1-[2-tert-butyl-4-[[5-(3,4-dichlorophenyl)pyridin-2-yl]methyl]piperazin-1-yl]-2-piperidin-4-yl-ethanone Openeye Name: 1-[2-tert-butyl-4-[[5-(3,4-dichlorophenyl)-2-pyridyl]methyl]piperazin-1-yl]-2-(4-piperidyl)ethanone CAS Name: 1-[2-tert-butyl-4-[[5-(3,4-dichlorophenyl)-2-pyridinyl]methyl]-1-piperazinyl]-2-(4-piperidinyl)ethanone IUPAC Name: 1-[2-tert-butyl-4-[[5-(3,4-dichlorophenyl)pyridin-2-yl]methyl]piperazin-1-yl]-2-piperidin-4-ylethanone Traditional Name: 1-[2-tert-butyl-4-[[5-(3,4-dichlorophenyl)-2-pyridyl]methyl]piperazino]-2-(4-piperidyl)ethanone Formula: C27H36Cl2N4O MolecularWeight: 503.50694

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CN(CCN1C(=O)CC2CCNCC2)CC3=NC=C(C=C3)C4=CC(=C(C=C4)Cl)Cl

Isomeric SMILES

CC(C)(C)C1CN(CCN1C(=O)CC2CCNCC2)CC3=NC=C(C=C3)C4=CC(=C(C=C4)Cl)Cl

InChI

InChI=1S/C27H36Cl2N4O/c1-27(2,3)25-18-32(12-13-33(25)26(34)14-19-8-10-30-11-9-19)17-22-6-4-21(16-31-22)20-5-7-23(28)24(29)15-20/h4-7,15-16,19,25,30H,8-14,17-18H2,1-3H3