N4-[3-(4-methylpiperazin-1-yl)propyl]-N2-(3-pyridin-4-ylphenyl)pyrimidine-2,4-diamine

Systemtic Name: N4-[3-(4-methylpiperazin-1-yl)propyl]-N2-(3-pyridin-4-ylphenyl)pyrimidine-2,4-diamine Openeye Name: N4-[3-(4-methylpiperazin-1-yl)propyl]-N2-[3-(4-pyridyl)phenyl]pyrimidine-2,4-diamine CAS Name: N4-[3-(4-methyl-1-piperazinyl)propyl]-N2-(3-pyridin-4-ylphenyl)pyrimidine-2,4-diamine IUPAC Name: 4-N-[3-(4-methylpiperazin-1-yl)propyl]-2-N-(3-pyridin-4-ylphenyl)pyrimidine-2,4-diamine Traditional Name: 3-(4-methylpiperazino)propyl-[2-[3-(4-pyridyl)anilino]pyrimidin-4-yl]amine Formula: C23H29N7 MolecularWeight: 403.52326

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CCCNC2=NC(=NC=C2)NC3=CC=CC(=C3)C4=CC=NC=C4

Isomeric SMILES

CN1CCN(CC1)CCCNC2=NC(=NC=C2)NC3=CC=CC(=C3)C4=CC=NC=C4

InChI

InChI=1S/C23H29N7/c1-29-14-16-30(17-15-29)13-3-9-25-22-8-12-26-23(28-22)27-21-5-2-4-20(18-21)19-6-10-24-11-7-19/h2,4-8,10-12,18H,3,9,13-17H2,1H3,(H2,25,26,27,28)