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

Systemtic Name: N-[4-[[2-methyl-6-[(4-methylphenyl)amino]pyrimidin-4-yl]amino]phenyl]-3-phenyl-propanamide Openeye Name: N-[4-[[2-methyl-6-(4-methylanilino)pyrimidin-4-yl]amino]phenyl]-3-phenyl-propanamide CAS Name: N-[4-[[2-methyl-6-(4-methylanilino)-4-pyrimidinyl]amino]phenyl]-3-phenylpropanamide IUPAC Name: N-[4-[[2-methyl-6-(4-methylanilino)pyrimidin-4-yl]amino]phenyl]-3-phenylpropanamide Traditional Name: N-[4-[[2-methyl-6-(p-toluidino)pyrimidin-4-yl]amino]phenyl]-3-phenyl-propionamide Formula: C27H27N5O MolecularWeight: 437.53618

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)CCC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)NC2=CC(=NC(=N2)C)NC3=CC=C(C=C3)NC(=O)CCC4=CC=CC=C4

InChI

InChI=1S/C27H27N5O/c1-19-8-11-22(12-9-19)30-25-18-26(29-20(2)28-25)31-23-13-15-24(16-14-23)32-27(33)17-10-21-6-4-3-5-7-21/h3-9,11-16,18H,10,17H2,1-2H3,(H,32,33)(H2,28,29,30,31)