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

Systemtic Name: 3-[[6-[methyl-(3-methylphenyl)amino]pyrimidin-4-yl]amino]-N-(2-pyridin-3-ylethyl)benzamide Openeye Name: 3-[[6-(N,3-dimethylanilino)pyrimidin-4-yl]amino]-N-[2-(3-pyridyl)ethyl]benzamide CAS Name: 3-[[6-(N,3-dimethylanilino)-4-pyrimidinyl]amino]-N-[2-(3-pyridinyl)ethyl]benzamide IUPAC Name: 3-[[6-(N,3-dimethylanilino)pyrimidin-4-yl]amino]-N-(2-pyridin-3-ylethyl)benzamide Traditional Name: 3-[[6-(N,3-dimethylanilino)pyrimidin-4-yl]amino]-N-[2-(3-pyridyl)ethyl]benzamide Formula: C26H26N6O MolecularWeight: 438.52424

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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)NCCC4=CN=CC=C4

Isomeric SMILES

CC1=CC(=CC=C1)N(C)C2=NC=NC(=C2)NC3=CC=CC(=C3)C(=O)NCCC4=CN=CC=C4

InChI

InChI=1S/C26H26N6O/c1-19-6-3-10-23(14-19)32(2)25-16-24(29-18-30-25)31-22-9-4-8-21(15-22)26(33)28-13-11-20-7-5-12-27-17-20/h3-10,12,14-18H,11,13H2,1-2H3,(H,28,33)(H,29,30,31)