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

Systemtic Name: 3-[[6-[methyl-(3-methylphenyl)amino]pyrimidin-4-yl]amino]-N-(pyridin-3-ylmethyl)benzamide Openeye Name: 3-[[6-(N,3-dimethylanilino)pyrimidin-4-yl]amino]-N-(3-pyridylmethyl)benzamide CAS Name: 3-[[6-(N,3-dimethylanilino)-4-pyrimidinyl]amino]-N-(3-pyridinylmethyl)benzamide IUPAC Name: 3-[[6-(N,3-dimethylanilino)pyrimidin-4-yl]amino]-N-(pyridin-3-ylmethyl)benzamide Traditional Name: 3-[[6-(N,3-dimethylanilino)pyrimidin-4-yl]amino]-N-(3-pyridylmethyl)benzamide Formula: C25H24N6O MolecularWeight: 424.49766

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H24N6O/c1-18-6-3-10-22(12-18)31(2)24-14-23(28-17-29-24)30-21-9-4-8-20(13-21)25(32)27-16-19-7-5-11-26-15-19/h3-15,17H,16H2,1-2H3,(H,27,32)(H,28,29,30)