2-(4-methylpiperazin-4-ium-1-yl)-6-(4-methylpiperidin-1-yl)-5-nitro-pyrimidin-4-amine

Systemtic Name: 2-(4-methylpiperazin-4-ium-1-yl)-6-(4-methylpiperidin-1-yl)-5-nitro-pyrimidin-4-amine Openeye Name: 2-(4-methylpiperazin-4-ium-1-yl)-6-(4-methyl-1-piperidyl)-5-nitro-pyrimidin-4-amine CAS Name: 2-(4-methyl-1-piperazin-4-iumyl)-6-(4-methyl-1-piperidinyl)-5-nitro-4-pyrimidinamine IUPAC Name: 2-(4-methylpiperazin-4-ium-1-yl)-6-(4-methylpiperidin-1-yl)-5-nitropyrimidin-4-amine Traditional Name: [2-(4-methylpiperazin-4-ium-1-yl)-6-(4-methylpiperidino)-5-nitro-pyrimidin-4-yl]amine Formula: C15H26N7O2+ MolecularWeight: 336.41264

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=C(C(=NC(=N2)N3CC[NH+](CC3)C)N)[N+](=O)[O-]

Isomeric SMILES

CC1CCN(CC1)C2=C(C(=NC(=N2)N3CC[NH+](CC3)C)N)[N+](=O)[O-]

InChI

InChI=1S/C15H25N7O2/c1-11-3-5-20(6-4-11)14-12(22(23)24)13(16)17-15(18-14)21-9-7-19(2)8-10-21/h11H,3-10H2,1-2H3,(H2,16,17,18)/p+1