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

Systemtic Name: N4-methyl-N6-(4-methylpiperazin-1-yl)-N4-(1-methylpiperidin-4-yl)-5-nitro-pyrimidine-4,6-diamine Openeye Name: N4-methyl-N6-(4-methylpiperazin-1-yl)-N4-(1-methyl-4-piperidyl)-5-nitro-pyrimidine-4,6-diamine CAS Name: N4-methyl-N6-(4-methyl-1-piperazinyl)-N4-(1-methyl-4-piperidinyl)-5-nitropyrimidine-4,6-diamine IUPAC Name: 4-N-methyl-6-N-(4-methylpiperazin-1-yl)-4-N-(1-methylpiperidin-4-yl)-5-nitropyrimidine-4,6-diamine Traditional Name: methyl-[6-[(4-methylpiperazino)amino]-5-nitro-pyrimidin-4-yl]-(1-methyl-4-piperidyl)amine Formula: C16H28N8O2 MolecularWeight: 364.44592

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(CC1)N(C)C2=NC=NC(=C2[N+](=O)[O-])NN3CCN(CC3)C

Isomeric SMILES

CN1CCC(CC1)N(C)C2=NC=NC(=C2[N+](=O)[O-])NN3CCN(CC3)C

InChI

InChI=1S/C16H28N8O2/c1-20-6-4-13(5-7-20)22(3)16-14(24(25)26)15(17-12-18-16)19-23-10-8-21(2)9-11-23/h12-13H,4-11H2,1-3H3,(H,17,18,19)