4-[2-[2-tert-butyl-4-[(4-chlorophenyl)-pyridin-2-yl-methyl]piperazin-1-yl]-2-oxidanylidene-ethyl]piperidine-1-carboxamide

Systemtic Name: 4-[2-[2-tert-butyl-4-[(4-chlorophenyl)-pyridin-2-yl-methyl]piperazin-1-yl]-2-oxidanylidene-ethyl]piperidine-1-carboxamide Openeye Name: 4-[2-[2-tert-butyl-4-[(4-chlorophenyl)-(2-pyridyl)methyl]piperazin-1-yl]-2-oxo-ethyl]piperidine-1-carboxamide CAS Name: 4-[2-[2-tert-butyl-4-[(4-chlorophenyl)-(2-pyridinyl)methyl]-1-piperazinyl]-2-oxoethyl]-1-piperidinecarboxamide IUPAC Name: 4-[2-[2-tert-butyl-4-[(4-chlorophenyl)-pyridin-2-ylmethyl]piperazin-1-yl]-2-oxoethyl]piperidine-1-carboxamide Traditional Name: 4-[2-[2-tert-butyl-4-[(4-chlorophenyl)-(2-pyridyl)methyl]piperazino]-2-keto-ethyl]piperidine-1-carboxamide Formula: C28H38ClN5O2 MolecularWeight: 512.08662

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CN(CCN1C(=O)CC2CCN(CC2)C(=O)N)C(C3=CC=C(C=C3)Cl)C4=CC=CC=N4

Isomeric SMILES

CC(C)(C)C1CN(CCN1C(=O)CC2CCN(CC2)C(=O)N)C(C3=CC=C(C=C3)Cl)C4=CC=CC=N4

InChI

InChI=1S/C28H38ClN5O2/c1-28(2,3)24-19-33(26(23-6-4-5-13-31-23)21-7-9-22(29)10-8-21)16-17-34(24)25(35)18-20-11-14-32(15-12-20)27(30)36/h4-10,13,20,24,26H,11-12,14-19H2,1-3H3,(H2,30,36)