N-[3-[[(2-azanylcyclohexyl)-(3,4-dimethoxyphenyl)carbonyl-amino]methyl]phenyl]pyridine-4-carboxamide

Systemtic Name: N-[3-[[(2-azanylcyclohexyl)-(3,4-dimethoxyphenyl)carbonyl-amino]methyl]phenyl]pyridine-4-carboxamide Openeye Name: N-[3-[[(2-aminocyclohexyl)-(3,4-dimethoxybenzoyl)amino]methyl]phenyl]pyridine-4-carboxamide CAS Name: N-[3-[[(2-aminocyclohexyl)-[(3,4-dimethoxyphenyl)-oxomethyl]amino]methyl]phenyl]-4-pyridinecarboxamide IUPAC Name: N-[3-[[(2-aminocyclohexyl)-(3,4-dimethoxybenzoyl)amino]methyl]phenyl]pyridine-4-carboxamide Traditional Name: N-[3-[[(2-aminocyclohexyl)-veratroyl-amino]methyl]phenyl]isonicotinamide Formula: C28H32N4O4 MolecularWeight: 488.57808

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)N(CC2=CC(=CC=C2)NC(=O)C3=CC=NC=C3)C4CCCCC4N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)N(CC2=CC(=CC=C2)NC(=O)C3=CC=NC=C3)C4CCCCC4N)OC

InChI

InChI=1S/C28H32N4O4/c1-35-25-11-10-21(17-26(25)36-2)28(34)32(24-9-4-3-8-23(24)29)18-19-6-5-7-22(16-19)31-27(33)20-12-14-30-15-13-20/h5-7,10-17,23-24H,3-4,8-9,18,29H2,1-2H3,(H,31,33)