5-chloranyl-6-[4-[1-(4-cyanophenyl)carbonylpiperidin-4-yl]piperazin-1-yl]-N-(2-phenoxyethyl)pyridine-3-carboxamide

Systemtic Name: 5-chloranyl-6-[4-[1-(4-cyanophenyl)carbonylpiperidin-4-yl]piperazin-1-yl]-N-(2-phenoxyethyl)pyridine-3-carboxamide Openeye Name: 5-chloro-6-[4-[1-(4-cyanobenzoyl)-4-piperidyl]piperazin-1-yl]-N-(2-phenoxyethyl)pyridine-3-carboxamide CAS Name: 5-chloro-6-[4-[1-[(4-cyanophenyl)-oxomethyl]-4-piperidinyl]-1-piperazinyl]-N-(2-phenoxyethyl)-3-pyridinecarboxamide IUPAC Name: 5-chloro-6-[4-[1-(4-cyanobenzoyl)piperidin-4-yl]piperazin-1-yl]-N-(2-phenoxyethyl)pyridine-3-carboxamide Traditional Name: 5-chloro-6-[4-[1-(4-cyanobenzoyl)-4-piperidyl]piperazino]-N-(2-phenoxyethyl)nicotinamide Formula: C31H33ClN6O3 MolecularWeight: 573.08512

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N2CCN(CC2)C3=C(C=C(C=N3)C(=O)NCCOC4=CC=CC=C4)Cl)C(=O)C5=CC=C(C=C5)C#N

Isomeric SMILES

C1CN(CCC1N2CCN(CC2)C3=C(C=C(C=N3)C(=O)NCCOC4=CC=CC=C4)Cl)C(=O)C5=CC=C(C=C5)C#N

InChI

InChI=1S/C31H33ClN6O3/c32-28-20-25(30(39)34-12-19-41-27-4-2-1-3-5-27)22-35-29(28)37-17-15-36(16-18-37)26-10-13-38(14-11-26)31(40)24-8-6-23(21-33)7-9-24/h1-9,20,22,26H,10-19H2,(H,34,39)