3-[[6-[methyl-(3-methylphenyl)amino]pyrimidin-4-yl]amino]-N-(2-piperidin-1-ylethyl)benzamide

Systemtic Name: 3-[[6-[methyl-(3-methylphenyl)amino]pyrimidin-4-yl]amino]-N-(2-piperidin-1-ylethyl)benzamide Openeye Name: 3-[[6-(N,3-dimethylanilino)pyrimidin-4-yl]amino]-N-[2-(1-piperidyl)ethyl]benzamide CAS Name: 3-[[6-(N,3-dimethylanilino)-4-pyrimidinyl]amino]-N-[2-(1-piperidinyl)ethyl]benzamide IUPAC Name: 3-[[6-(N,3-dimethylanilino)pyrimidin-4-yl]amino]-N-(2-piperidin-1-ylethyl)benzamide Traditional Name: 3-[[6-(N,3-dimethylanilino)pyrimidin-4-yl]amino]-N-(2-piperidinoethyl)benzamide Formula: C26H32N6O MolecularWeight: 444.57188

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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)NCCN4CCCCC4

Isomeric SMILES

CC1=CC(=CC=C1)N(C)C2=NC=NC(=C2)NC3=CC=CC(=C3)C(=O)NCCN4CCCCC4

InChI

InChI=1S/C26H32N6O/c1-20-8-6-11-23(16-20)31(2)25-18-24(28-19-29-25)30-22-10-7-9-21(17-22)26(33)27-12-15-32-13-4-3-5-14-32/h6-11,16-19H,3-5,12-15H2,1-2H3,(H,27,33)(H,28,29,30)