N4-(4-methylpiperazin-1-yl)-N6-(pyridin-3-ylmethyl)pyrimidine-4,5,6-triamine

Systemtic Name: N4-(4-methylpiperazin-1-yl)-N6-(pyridin-3-ylmethyl)pyrimidine-4,5,6-triamine Openeye Name: N4-(4-methylpiperazin-1-yl)-N6-(3-pyridylmethyl)pyrimidine-4,5,6-triamine CAS Name: N4-(4-methyl-1-piperazinyl)-N6-(3-pyridinylmethyl)pyrimidine-4,5,6-triamine IUPAC Name: 4-N-(4-methylpiperazin-1-yl)-6-N-(pyridin-3-ylmethyl)pyrimidine-4,5,6-triamine Traditional Name: [5-amino-6-[(4-methylpiperazino)amino]pyrimidin-4-yl]-(3-pyridylmethyl)amine Formula: C15H22N8 MolecularWeight: 314.38878

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)NC2=NC=NC(=C2N)NCC3=CN=CC=C3

Isomeric SMILES

CN1CCN(CC1)NC2=NC=NC(=C2N)NCC3=CN=CC=C3

InChI

InChI=1S/C15H22N8/c1-22-5-7-23(8-6-22)21-15-13(16)14(19-11-20-15)18-10-12-3-2-4-17-9-12/h2-4,9,11H,5-8,10,16H2,1H3,(H2,18,19,20,21)