2-[4-(2-ethylphenyl)piperazin-1-yl]-N-(4-methylphenyl)-6-piperidin-1-yl-pyrimidin-4-amine

Systemtic Name: 2-[4-(2-ethylphenyl)piperazin-1-yl]-N-(4-methylphenyl)-6-piperidin-1-yl-pyrimidin-4-amine Openeye Name: 2-[4-(2-ethylphenyl)piperazin-1-yl]-6-(1-piperidyl)-N-(p-tolyl)pyrimidin-4-amine CAS Name: 2-[4-(2-ethylphenyl)-1-piperazinyl]-N-(4-methylphenyl)-6-(1-piperidinyl)-4-pyrimidinamine IUPAC Name: 2-[4-(2-ethylphenyl)piperazin-1-yl]-N-(4-methylphenyl)-6-piperidin-1-ylpyrimidin-4-amine Traditional Name: [2-[4-(2-ethylphenyl)piperazino]-6-piperidino-pyrimidin-4-yl]-(p-tolyl)amine Formula: C28H36N6 MolecularWeight: 456.62564

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1N2CCN(CC2)C3=NC(=CC(=N3)NC4=CC=C(C=C4)C)N5CCCCC5

Isomeric SMILES

CCC1=CC=CC=C1N2CCN(CC2)C3=NC(=CC(=N3)NC4=CC=C(C=C4)C)N5CCCCC5

InChI

InChI=1S/C28H36N6/c1-3-23-9-5-6-10-25(23)32-17-19-34(20-18-32)28-30-26(29-24-13-11-22(2)12-14-24)21-27(31-28)33-15-7-4-8-16-33/h5-6,9-14,21H,3-4,7-8,15-20H2,1-2H3,(H,29,30,31)