2-[4-[[6-[methyl-(3-methylphenyl)amino]pyrimidin-4-yl]amino]phenyl]-1-piperidin-1-yl-ethanone

Systemtic Name: 2-[4-[[6-[methyl-(3-methylphenyl)amino]pyrimidin-4-yl]amino]phenyl]-1-piperidin-1-yl-ethanone Openeye Name: 2-[4-[[6-(N,3-dimethylanilino)pyrimidin-4-yl]amino]phenyl]-1-(1-piperidyl)ethanone CAS Name: 2-[4-[[6-(N,3-dimethylanilino)-4-pyrimidinyl]amino]phenyl]-1-(1-piperidinyl)ethanone IUPAC Name: 2-[4-[[6-(N,3-dimethylanilino)pyrimidin-4-yl]amino]phenyl]-1-piperidin-1-ylethanone Traditional Name: 2-[4-[[6-(N,3-dimethylanilino)pyrimidin-4-yl]amino]phenyl]-1-piperidino-ethanone Formula: C25H29N5O MolecularWeight: 415.53066

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N(C)C2=NC=NC(=C2)NC3=CC=C(C=C3)CC(=O)N4CCCCC4

Isomeric SMILES

CC1=CC(=CC=C1)N(C)C2=NC=NC(=C2)NC3=CC=C(C=C3)CC(=O)N4CCCCC4

InChI

InChI=1S/C25H29N5O/c1-19-7-6-8-22(15-19)29(2)24-17-23(26-18-27-24)28-21-11-9-20(10-12-21)16-25(31)30-13-4-3-5-14-30/h6-12,15,17-18H,3-5,13-14,16H2,1-2H3,(H,26,27,28)