6-(benzimidazol-1-yl)-N-butyl-5-nitro-pyrimidin-4-amine

Systemtic Name: 6-(benzimidazol-1-yl)-N-butyl-5-nitro-pyrimidin-4-amine Openeye Name: 6-(benzimidazol-1-yl)-N-butyl-5-nitro-pyrimidin-4-amine CAS Name: 6-(1-benzimidazolyl)-N-butyl-5-nitro-4-pyrimidinamine IUPAC Name: 6-(benzimidazol-1-yl)-N-butyl-5-nitropyrimidin-4-amine Traditional Name: [6-(benzimidazol-1-yl)-5-nitro-pyrimidin-4-yl]-butyl-amine Formula: C15H16N6O2 MolecularWeight: 312.32654

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=NC=NC(=C1[N+](=O)[O-])N2C=NC3=CC=CC=C32

Isomeric SMILES

CCCCNC1=NC=NC(=C1[N+](=O)[O-])N2C=NC3=CC=CC=C32

InChI

InChI=1S/C15H16N6O2/c1-2-3-8-16-14-13(21(22)23)15(18-9-17-14)20-10-19-11-6-4-5-7-12(11)20/h4-7,9-10H,2-3,8H2,1H3,(H,16,17,18)