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

Systemtic Name: N-[5-[(4-azanylcyclohexyl)carbamoyl]-2-(4-cyclopropylcarbonylpiperazin-1-yl)phenyl]pyridine-4-carboxamide Openeye Name: N-[5-[(4-aminocyclohexyl)carbamoyl]-2-[4-(cyclopropanecarbonyl)piperazin-1-yl]phenyl]pyridine-4-carboxamide CAS Name: N-[5-[[(4-aminocyclohexyl)amino]-oxomethyl]-2-[4-[cyclopropyl(oxo)methyl]-1-piperazinyl]phenyl]-4-pyridinecarboxamide IUPAC Name: N-[5-[(4-aminocyclohexyl)carbamoyl]-2-[4-(cyclopropanecarbonyl)piperazin-1-yl]phenyl]pyridine-4-carboxamide Traditional Name: N-[5-[(4-aminocyclohexyl)carbamoyl]-2-[4-(cyclopropanecarbonyl)piperazino]phenyl]isonicotinamide Formula: C27H34N6O3 MolecularWeight: 490.59726

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(=O)N2CCN(CC2)C3=C(C=C(C=C3)C(=O)NC4CCC(CC4)N)NC(=O)C5=CC=NC=C5

Isomeric SMILES

C1CC1C(=O)N2CCN(CC2)C3=C(C=C(C=C3)C(=O)NC4CCC(CC4)N)NC(=O)C5=CC=NC=C5

InChI

InChI=1S/C27H34N6O3/c28-21-4-6-22(7-5-21)30-26(35)20-3-8-24(23(17-20)31-25(34)18-9-11-29-12-10-18)32-13-15-33(16-14-32)27(36)19-1-2-19/h3,8-12,17,19,21-22H,1-2,4-7,13-16,28H2,(H,30,35)(H,31,34)