3-[[6-[(3-methylphenyl)amino]pyrimidin-4-yl]amino]-N-(pyridin-4-ylmethyl)benzamide

Systemtic Name: 3-[[6-[(3-methylphenyl)amino]pyrimidin-4-yl]amino]-N-(pyridin-4-ylmethyl)benzamide Openeye Name: 3-[[6-(3-methylanilino)pyrimidin-4-yl]amino]-N-(4-pyridylmethyl)benzamide CAS Name: 3-[[6-(3-methylanilino)-4-pyrimidinyl]amino]-N-(pyridin-4-ylmethyl)benzamide IUPAC Name: 3-[[6-(3-methylanilino)pyrimidin-4-yl]amino]-N-(pyridin-4-ylmethyl)benzamide Traditional Name: 3-[[6-(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=NC(=C2)NC3=CC=CC(=C3)C(=O)NCC4=CC=NC=C4

Isomeric SMILES

CC1=CC(=CC=C1)NC2=NC=NC(=C2)NC3=CC=CC(=C3)C(=O)NCC4=CC=NC=C4

InChI

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