2-(4-methylphenyl)-4-[[3-[(4-methylpiperazin-1-yl)methyl]phenyl]carbonylamino]pyridine-3-carboxamide

Systemtic Name: 2-(4-methylphenyl)-4-[[3-[(4-methylpiperazin-1-yl)methyl]phenyl]carbonylamino]pyridine-3-carboxamide Openeye Name: 4-[[3-[(4-methylpiperazin-1-yl)methyl]benzoyl]amino]-2-(p-tolyl)pyridine-3-carboxamide CAS Name: 2-(4-methylphenyl)-4-[[[3-[(4-methyl-1-piperazinyl)methyl]phenyl]-oxomethyl]amino]-3-pyridinecarboxamide IUPAC Name: 2-(4-methylphenyl)-4-[[3-[(4-methylpiperazin-1-yl)methyl]benzoyl]amino]pyridine-3-carboxamide Traditional Name: 4-[[3-[(4-methylpiperazino)methyl]benzoyl]amino]-2-(p-tolyl)nicotinamide Formula: C26H29N5O2 MolecularWeight: 443.54076

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC=CC(=C2C(=O)N)NC(=O)C3=CC(=CC=C3)CN4CCN(CC4)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC=CC(=C2C(=O)N)NC(=O)C3=CC(=CC=C3)CN4CCN(CC4)C

InChI

InChI=1S/C26H29N5O2/c1-18-6-8-20(9-7-18)24-23(25(27)32)22(10-11-28-24)29-26(33)21-5-3-4-19(16-21)17-31-14-12-30(2)13-15-31/h3-11,16H,12-15,17H2,1-2H3,(H2,27,32)(H,28,29,33)