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

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

Click to see the large picture

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=C(C=C4)Cl

Isomeric SMILES

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

InChI

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