N4-butyl-N6-(3-imidazol-1-ylpropyl)-N4-methyl-5-nitro-pyrimidine-4,6-diamine

Systemtic Name: N4-butyl-N6-(3-imidazol-1-ylpropyl)-N4-methyl-5-nitro-pyrimidine-4,6-diamine Openeye Name: N4-butyl-N6-(3-imidazol-1-ylpropyl)-N4-methyl-5-nitro-pyrimidine-4,6-diamine CAS Name: N4-butyl-N6-[3-(1-imidazolyl)propyl]-N4-methyl-5-nitropyrimidine-4,6-diamine IUPAC Name: 4-N-butyl-6-N-(3-imidazol-1-ylpropyl)-4-N-methyl-5-nitropyrimidine-4,6-diamine Traditional Name: butyl-[6-(3-imidazol-1-ylpropylamino)-5-nitro-pyrimidin-4-yl]-methyl-amine Formula: C15H23N7O2 MolecularWeight: 333.38882

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C)C1=NC=NC(=C1[N+](=O)[O-])NCCCN2C=CN=C2

Isomeric SMILES

CCCCN(C)C1=NC=NC(=C1[N+](=O)[O-])NCCCN2C=CN=C2

InChI

InChI=1S/C15H23N7O2/c1-3-4-8-20(2)15-13(22(23)24)14(18-11-19-15)17-6-5-9-21-10-7-16-12-21/h7,10-12H,3-6,8-9H2,1-2H3,(H,17,18,19)