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

Systemtic Name: 3-chloranyl-N-[4-[[2-methyl-6-[(4-methylphenyl)amino]pyrimidin-4-yl]amino]phenyl]benzamide Openeye Name: 3-chloro-N-[4-[[2-methyl-6-(4-methylanilino)pyrimidin-4-yl]amino]phenyl]benzamide CAS Name: 3-chloro-N-[4-[[2-methyl-6-(4-methylanilino)-4-pyrimidinyl]amino]phenyl]benzamide IUPAC Name: 3-chloro-N-[4-[[2-methyl-6-(4-methylanilino)pyrimidin-4-yl]amino]phenyl]benzamide Traditional Name: 3-chloro-N-[4-[[2-methyl-6-(p-toluidino)pyrimidin-4-yl]amino]phenyl]benzamide Formula: C25H22ClN5O MolecularWeight: 443.92808

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC2=CC(=NC(=N2)C)NC3=CC=C(C=C3)NC(=O)C4=CC(=CC=C4)Cl

Isomeric SMILES

CC1=CC=C(C=C1)NC2=CC(=NC(=N2)C)NC3=CC=C(C=C3)NC(=O)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C25H22ClN5O/c1-16-6-8-20(9-7-16)29-23-15-24(28-17(2)27-23)30-21-10-12-22(13-11-21)31-25(32)18-4-3-5-19(26)14-18/h3-15H,1-2H3,(H,31,32)(H2,27,28,29,30)