N-[3-[[(2-azanylcyclohexyl)-(phenylcarbonyl)amino]methyl]-4-chloranyl-phenyl]pyridine-4-carboxamide

Systemtic Name: N-[3-[[(2-azanylcyclohexyl)-(phenylcarbonyl)amino]methyl]-4-chloranyl-phenyl]pyridine-4-carboxamide Openeye Name: N-[3-[[(2-aminocyclohexyl)-benzoyl-amino]methyl]-4-chloro-phenyl]pyridine-4-carboxamide CAS Name: N-[3-[[(2-aminocyclohexyl)-benzoylamino]methyl]-4-chlorophenyl]-4-pyridinecarboxamide IUPAC Name: N-[3-[[(2-aminocyclohexyl)-benzoylamino]methyl]-4-chlorophenyl]pyridine-4-carboxamide Traditional Name: N-[3-[[(2-aminocyclohexyl)-benzoyl-amino]methyl]-4-chloro-phenyl]isonicotinamide Formula: C26H27ClN4O2 MolecularWeight: 462.97118

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)N)N(CC2=C(C=CC(=C2)NC(=O)C3=CC=NC=C3)Cl)C(=O)C4=CC=CC=C4

Isomeric SMILES

C1CCC(C(C1)N)N(CC2=C(C=CC(=C2)NC(=O)C3=CC=NC=C3)Cl)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C26H27ClN4O2/c27-22-11-10-21(30-25(32)18-12-14-29-15-13-18)16-20(22)17-31(24-9-5-4-8-23(24)28)26(33)19-6-2-1-3-7-19/h1-3,6-7,10-16,23-24H,4-5,8-9,17,28H2,(H,30,32)