N-(2-methylbutyl)-3-[[6-[methyl-(3-methylphenyl)amino]pyrimidin-4-yl]amino]benzamide

Systemtic Name: N-(2-methylbutyl)-3-[[6-[methyl-(3-methylphenyl)amino]pyrimidin-4-yl]amino]benzamide Openeye Name: 3-[[6-(N,3-dimethylanilino)pyrimidin-4-yl]amino]-N-(2-methylbutyl)benzamide CAS Name: 3-[[6-(N,3-dimethylanilino)-4-pyrimidinyl]amino]-N-(2-methylbutyl)benzamide IUPAC Name: 3-[[6-(N,3-dimethylanilino)pyrimidin-4-yl]amino]-N-(2-methylbutyl)benzamide Traditional Name: 3-[[6-(N,3-dimethylanilino)pyrimidin-4-yl]amino]-N-(2-methylbutyl)benzamide Formula: C24H29N5O MolecularWeight: 403.51996

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)CNC(=O)C1=CC(=CC=C1)NC2=CC(=NC=N2)N(C)C3=CC=CC(=C3)C

Isomeric SMILES

CCC(C)CNC(=O)C1=CC(=CC=C1)NC2=CC(=NC=N2)N(C)C3=CC=CC(=C3)C

InChI

InChI=1S/C24H29N5O/c1-5-17(2)15-25-24(30)19-9-7-10-20(13-19)28-22-14-23(27-16-26-22)29(4)21-11-6-8-18(3)12-21/h6-14,16-17H,5,15H2,1-4H3,(H,25,30)(H,26,27,28)