3-[[2-[(3-methylphenyl)amino]pyrimidin-4-yl]amino]-N-(pyridin-4-ylmethyl)benzamide

Systemtic Name: 3-[[2-[(3-methylphenyl)amino]pyrimidin-4-yl]amino]-N-(pyridin-4-ylmethyl)benzamide Openeye Name: 3-[[2-(3-methylanilino)pyrimidin-4-yl]amino]-N-(4-pyridylmethyl)benzamide CAS Name: 3-[[2-(3-methylanilino)-4-pyrimidinyl]amino]-N-(pyridin-4-ylmethyl)benzamide IUPAC Name: 3-[[2-(3-methylanilino)pyrimidin-4-yl]amino]-N-(pyridin-4-ylmethyl)benzamide Traditional Name: 3-[[2-(m-toluidino)pyrimidin-4-yl]amino]-N-(4-pyridylmethyl)benzamide Formula: C24H22N6O MolecularWeight: 410.47108

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC2=NC=CC(=N2)NC3=CC=CC(=C3)C(=O)NCC4=CC=NC=C4

Isomeric SMILES

CC1=CC(=CC=C1)NC2=NC=CC(=N2)NC3=CC=CC(=C3)C(=O)NCC4=CC=NC=C4

InChI

InChI=1S/C24H22N6O/c1-17-4-2-6-20(14-17)29-24-26-13-10-22(30-24)28-21-7-3-5-19(15-21)23(31)27-16-18-8-11-25-12-9-18/h2-15H,16H2,1H3,(H,27,31)(H2,26,28,29,30)