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

Systemtic Name: 3-[[6-[methyl-(3-methylphenyl)amino]pyrimidin-4-yl]amino]-N-(4-methylpentan-2-yl)benzamide Openeye Name: 3-[[6-(N,3-dimethylanilino)pyrimidin-4-yl]amino]-N-(1,3-dimethylbutyl)benzamide CAS Name: 3-[[6-(N,3-dimethylanilino)-4-pyrimidinyl]amino]-N-(4-methylpentan-2-yl)benzamide IUPAC Name: 3-[[6-(N,3-dimethylanilino)pyrimidin-4-yl]amino]-N-(4-methylpentan-2-yl)benzamide Traditional Name: 3-[[6-(N,3-dimethylanilino)pyrimidin-4-yl]amino]-N-(1,3-dimethylbutyl)benzamide Formula: C25H31N5O MolecularWeight: 417.54654

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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)NC(C)CC(C)C

Isomeric SMILES

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

InChI

InChI=1S/C25H31N5O/c1-17(2)12-19(4)28-25(31)20-9-7-10-21(14-20)29-23-15-24(27-16-26-23)30(5)22-11-6-8-18(3)13-22/h6-11,13-17,19H,12H2,1-5H3,(H,28,31)(H,26,27,29)