4-[2-methyl-6-(4-methylpiperazin-1-yl)pyrimidin-4-yl]-N-(4-methylphenyl)piperazine-1-carboxamide

Systemtic Name: 4-[2-methyl-6-(4-methylpiperazin-1-yl)pyrimidin-4-yl]-N-(4-methylphenyl)piperazine-1-carboxamide Openeye Name: 4-[2-methyl-6-(4-methylpiperazin-1-yl)pyrimidin-4-yl]-N-(p-tolyl)piperazine-1-carboxamide CAS Name: 4-[2-methyl-6-(4-methyl-1-piperazinyl)-4-pyrimidinyl]-N-(4-methylphenyl)-1-piperazinecarboxamide IUPAC Name: 4-[2-methyl-6-(4-methylpiperazin-1-yl)pyrimidin-4-yl]-N-(4-methylphenyl)piperazine-1-carboxamide Traditional Name: 4-[2-methyl-6-(4-methylpiperazino)pyrimidin-4-yl]-N-(p-tolyl)piperazine-1-carboxamide Formula: C22H31N7O MolecularWeight: 409.52784

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)N2CCN(CC2)C3=CC(=NC(=N3)C)N4CCN(CC4)C

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)N2CCN(CC2)C3=CC(=NC(=N3)C)N4CCN(CC4)C

InChI

InChI=1S/C22H31N7O/c1-17-4-6-19(7-5-17)25-22(30)29-14-12-28(13-15-29)21-16-20(23-18(2)24-21)27-10-8-26(3)9-11-27/h4-7,16H,8-15H2,1-3H3,(H,25,30)