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

Systemtic Name: 1-[4-[4-methyl-6-[(4-methylphenyl)amino]pyrimidin-2-yl]piperazin-1-yl]-2-phenyl-ethanone Openeye Name: 1-[4-[4-methyl-6-(4-methylanilino)pyrimidin-2-yl]piperazin-1-yl]-2-phenyl-ethanone CAS Name: 1-[4-[4-methyl-6-(4-methylanilino)-2-pyrimidinyl]-1-piperazinyl]-2-phenylethanone IUPAC Name: 1-[4-[4-methyl-6-(4-methylanilino)pyrimidin-2-yl]piperazin-1-yl]-2-phenylethanone Traditional Name: 1-[4-[4-methyl-6-(p-toluidino)pyrimidin-2-yl]piperazino]-2-phenyl-ethanone Formula: C24H27N5O MolecularWeight: 401.50408

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC2=NC(=NC(=C2)C)N3CCN(CC3)C(=O)CC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)NC2=NC(=NC(=C2)C)N3CCN(CC3)C(=O)CC4=CC=CC=C4

InChI

InChI=1S/C24H27N5O/c1-18-8-10-21(11-9-18)26-22-16-19(2)25-24(27-22)29-14-12-28(13-15-29)23(30)17-20-6-4-3-5-7-20/h3-11,16H,12-15,17H2,1-2H3,(H,25,26,27)