4-(2-cyanophenyl)-N-[4-methoxy-3-(1-propan-2-ylpiperidin-4-yl)phenyl]piperazine-1-carboxamide

Systemtic Name: 4-(2-cyanophenyl)-N-[4-methoxy-3-(1-propan-2-ylpiperidin-4-yl)phenyl]piperazine-1-carboxamide Openeye Name: 4-(2-cyanophenyl)-N-[3-(1-isopropyl-4-piperidyl)-4-methoxy-phenyl]piperazine-1-carboxamide CAS Name: 4-(2-cyanophenyl)-N-[4-methoxy-3-(1-propan-2-yl-4-piperidinyl)phenyl]-1-piperazinecarboxamide IUPAC Name: 4-(2-cyanophenyl)-N-[4-methoxy-3-(1-propan-2-ylpiperidin-4-yl)phenyl]piperazine-1-carboxamide Traditional Name: 4-(2-cyanophenyl)-N-[3-(1-isopropyl-4-piperidyl)-4-methoxy-phenyl]piperazine-1-carboxamide Formula: C27H35N5O2 MolecularWeight: 461.5991

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1CCC(CC1)C2=C(C=CC(=C2)NC(=O)N3CCN(CC3)C4=CC=CC=C4C#N)OC

Isomeric SMILES

CC(C)N1CCC(CC1)C2=C(C=CC(=C2)NC(=O)N3CCN(CC3)C4=CC=CC=C4C#N)OC

InChI

InChI=1S/C27H35N5O2/c1-20(2)30-12-10-21(11-13-30)24-18-23(8-9-26(24)34-3)29-27(33)32-16-14-31(15-17-32)25-7-5-4-6-22(25)19-28/h4-9,18,20-21H,10-17H2,1-3H3,(H,29,33)