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

Systemtic Name: 6-(benzimidazol-1-yl)-5-nitro-N-propyl-pyrimidin-4-amine Openeye Name: 6-(benzimidazol-1-yl)-5-nitro-N-propyl-pyrimidin-4-amine CAS Name: 6-(1-benzimidazolyl)-5-nitro-N-propyl-4-pyrimidinamine IUPAC Name: 6-(benzimidazol-1-yl)-5-nitro-N-propylpyrimidin-4-amine Traditional Name: [6-(benzimidazol-1-yl)-5-nitro-pyrimidin-4-yl]-propyl-amine Formula: C14H14N6O2 MolecularWeight: 298.29996

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCNC1=NC=NC(=C1[N+](=O)[O-])N2C=NC3=CC=CC=C32

Isomeric SMILES

CCCNC1=NC=NC(=C1[N+](=O)[O-])N2C=NC3=CC=CC=C32

InChI

InChI=1S/C14H14N6O2/c1-2-7-15-13-12(20(21)22)14(17-8-16-13)19-9-18-10-5-3-4-6-11(10)19/h3-6,8-9H,2,7H2,1H3,(H,15,16,17)