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

Systemtic Name: N6-butyl-N4-methyl-N4-(1-methylpiperidin-4-yl)-5-nitro-pyrimidine-4,6-diamine Openeye Name: N6-butyl-N4-methyl-N4-(1-methyl-4-piperidyl)-5-nitro-pyrimidine-4,6-diamine CAS Name: N6-butyl-N4-methyl-N4-(1-methyl-4-piperidinyl)-5-nitropyrimidine-4,6-diamine IUPAC Name: 6-N-butyl-4-N-methyl-4-N-(1-methylpiperidin-4-yl)-5-nitropyrimidine-4,6-diamine Traditional Name: [6-(butylamino)-5-nitro-pyrimidin-4-yl]-methyl-(1-methyl-4-piperidyl)amine Formula: C15H26N6O2 MolecularWeight: 322.40594

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=C(C(=NC=N1)N(C)C2CCN(CC2)C)[N+](=O)[O-]

Isomeric SMILES

CCCCNC1=C(C(=NC=N1)N(C)C2CCN(CC2)C)[N+](=O)[O-]

InChI

InChI=1S/C15H26N6O2/c1-4-5-8-16-14-13(21(22)23)15(18-11-17-14)20(3)12-6-9-19(2)10-7-12/h11-12H,4-10H2,1-3H3,(H,16,17,18)