N-[5-[(4-azanylcyclohexyl)carbamoyl]-2-[4-(4-cyanophenyl)carbonylpiperazin-1-yl]phenyl]pyridine-4-carboxamide

Systemtic Name: N-[5-[(4-azanylcyclohexyl)carbamoyl]-2-[4-(4-cyanophenyl)carbonylpiperazin-1-yl]phenyl]pyridine-4-carboxamide Openeye Name: N-[5-[(4-aminocyclohexyl)carbamoyl]-2-[4-(4-cyanobenzoyl)piperazin-1-yl]phenyl]pyridine-4-carboxamide CAS Name: N-[5-[[(4-aminocyclohexyl)amino]-oxomethyl]-2-[4-[(4-cyanophenyl)-oxomethyl]-1-piperazinyl]phenyl]-4-pyridinecarboxamide IUPAC Name: N-[5-[(4-aminocyclohexyl)carbamoyl]-2-[4-(4-cyanobenzoyl)piperazin-1-yl]phenyl]pyridine-4-carboxamide Traditional Name: N-[5-[(4-aminocyclohexyl)carbamoyl]-2-[4-(4-cyanobenzoyl)piperazino]phenyl]isonicotinamide Formula: C31H33N7O3 MolecularWeight: 551.63882

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1N)NC(=O)C2=CC(=C(C=C2)N3CCN(CC3)C(=O)C4=CC=C(C=C4)C#N)NC(=O)C5=CC=NC=C5

Isomeric SMILES

C1CC(CCC1N)NC(=O)C2=CC(=C(C=C2)N3CCN(CC3)C(=O)C4=CC=C(C=C4)C#N)NC(=O)C5=CC=NC=C5

InChI

InChI=1S/C31H33N7O3/c32-20-21-1-3-23(4-2-21)31(41)38-17-15-37(16-18-38)28-10-5-24(30(40)35-26-8-6-25(33)7-9-26)19-27(28)36-29(39)22-11-13-34-14-12-22/h1-5,10-14,19,25-26H,6-9,15-18,33H2,(H,35,40)(H,36,39)