N4-(pyridin-3-ylmethyl)-6-(4-pyridin-2-ylpiperazin-1-yl)pyrimidine-4,5-diamine

Systemtic Name: N4-(pyridin-3-ylmethyl)-6-(4-pyridin-2-ylpiperazin-1-yl)pyrimidine-4,5-diamine Openeye Name: N4-(3-pyridylmethyl)-6-[4-(2-pyridyl)piperazin-1-yl]pyrimidine-4,5-diamine CAS Name: N4-(3-pyridinylmethyl)-6-[4-(2-pyridinyl)-1-piperazinyl]pyrimidine-4,5-diamine IUPAC Name: 4-N-(pyridin-3-ylmethyl)-6-(4-pyridin-2-ylpiperazin-1-yl)pyrimidine-4,5-diamine Traditional Name: [5-amino-6-[4-(2-pyridyl)piperazino]pyrimidin-4-yl]-(3-pyridylmethyl)amine Formula: C19H22N8 MolecularWeight: 362.43158

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=N2)C3=C(C(=NC=N3)NCC4=CN=CC=C4)N

Isomeric SMILES

C1CN(CCN1C2=CC=CC=N2)C3=C(C(=NC=N3)NCC4=CN=CC=C4)N

InChI

InChI=1S/C19H22N8/c20-17-18(23-13-15-4-3-6-21-12-15)24-14-25-19(17)27-10-8-26(9-11-27)16-5-1-2-7-22-16/h1-7,12,14H,8-11,13,20H2,(H,23,24,25)