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

Systemtic Name: N-(2-methylbutan-2-yl)-3-[[6-[(3-methylphenyl)amino]pyrimidin-4-yl]amino]benzamide Openeye Name: N-(1,1-dimethylpropyl)-3-[[6-(3-methylanilino)pyrimidin-4-yl]amino]benzamide CAS Name: 3-[[6-(3-methylanilino)-4-pyrimidinyl]amino]-N-(2-methylbutan-2-yl)benzamide IUPAC Name: 3-[[6-(3-methylanilino)pyrimidin-4-yl]amino]-N-(2-methylbutan-2-yl)benzamide Traditional Name: N-tert-amyl-3-[[6-(m-toluidino)pyrimidin-4-yl]amino]benzamide Formula: C23H27N5O MolecularWeight: 389.49338

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)NC(=O)C1=CC(=CC=C1)NC2=CC(=NC=N2)NC3=CC=CC(=C3)C

Isomeric SMILES

CCC(C)(C)NC(=O)C1=CC(=CC=C1)NC2=CC(=NC=N2)NC3=CC=CC(=C3)C

InChI

InChI=1S/C23H27N5O/c1-5-23(3,4)28-22(29)17-9-7-11-19(13-17)27-21-14-20(24-15-25-21)26-18-10-6-8-16(2)12-18/h6-15H,5H2,1-4H3,(H,28,29)(H2,24,25,26,27)