N4-(4-methylpiperazin-1-yl)-5-nitro-N6-quinolin-5-yl-pyrimidine-4,6-diamine

Systemtic Name: N4-(4-methylpiperazin-1-yl)-5-nitro-N6-quinolin-5-yl-pyrimidine-4,6-diamine Openeye Name: N4-(4-methylpiperazin-1-yl)-5-nitro-N6-(5-quinolyl)pyrimidine-4,6-diamine CAS Name: N4-(4-methyl-1-piperazinyl)-5-nitro-N6-(5-quinolinyl)pyrimidine-4,6-diamine IUPAC Name: 4-N-(4-methylpiperazin-1-yl)-5-nitro-6-N-quinolin-5-ylpyrimidine-4,6-diamine Traditional Name: (4-methylpiperazino)-[5-nitro-6-(5-quinolylamino)pyrimidin-4-yl]amine Formula: C18H20N8O2 MolecularWeight: 380.4038

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)NC2=NC=NC(=C2[N+](=O)[O-])NC3=CC=CC4=C3C=CC=N4

Isomeric SMILES

CN1CCN(CC1)NC2=NC=NC(=C2[N+](=O)[O-])NC3=CC=CC4=C3C=CC=N4

InChI

InChI=1S/C18H20N8O2/c1-24-8-10-25(11-9-24)23-18-16(26(27)28)17(20-12-21-18)22-15-6-2-5-14-13(15)4-3-7-19-14/h2-7,12H,8-11H2,1H3,(H2,20,21,22,23)