N-[[3,4-bis(fluoranyl)phenyl]methyl]-5-chloranyl-6-[4-[1-(4-cyanophenyl)carbonylpiperidin-4-yl]piperazin-1-yl]pyridine-3-carboxamide

Systemtic Name: N-[[3,4-bis(fluoranyl)phenyl]methyl]-5-chloranyl-6-[4-[1-(4-cyanophenyl)carbonylpiperidin-4-yl]piperazin-1-yl]pyridine-3-carboxamide Openeye Name: 5-chloro-6-[4-[1-(4-cyanobenzoyl)-4-piperidyl]piperazin-1-yl]-N-[(3,4-difluorophenyl)methyl]pyridine-3-carboxamide CAS Name: 5-chloro-6-[4-[1-[(4-cyanophenyl)-oxomethyl]-4-piperidinyl]-1-piperazinyl]-N-[(3,4-difluorophenyl)methyl]-3-pyridinecarboxamide IUPAC Name: 5-chloro-6-[4-[1-(4-cyanobenzoyl)piperidin-4-yl]piperazin-1-yl]-N-[(3,4-difluorophenyl)methyl]pyridine-3-carboxamide Traditional Name: 5-chloro-6-[4-[1-(4-cyanobenzoyl)-4-piperidyl]piperazino]-N-(3,4-difluorobenzyl)nicotinamide Formula: C30H29ClF2N6O2 MolecularWeight: 579.040066

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N2CCN(CC2)C3=C(C=C(C=N3)C(=O)NCC4=CC(=C(C=C4)F)F)Cl)C(=O)C5=CC=C(C=C5)C#N

Isomeric SMILES

C1CN(CCC1N2CCN(CC2)C3=C(C=C(C=N3)C(=O)NCC4=CC(=C(C=C4)F)F)Cl)C(=O)C5=CC=C(C=C5)C#N

InChI

InChI=1S/C30H29ClF2N6O2/c31-25-16-23(29(40)36-18-21-3-6-26(32)27(33)15-21)19-35-28(25)38-13-11-37(12-14-38)24-7-9-39(10-8-24)30(41)22-4-1-20(17-34)2-5-22/h1-6,15-16,19,24H,7-14,18H2,(H,36,40)