6-(benzimidazol-1-yl)-N-(2,3-dimethylphenyl)-5-nitro-pyrimidin-4-amine

Systemtic Name: 6-(benzimidazol-1-yl)-N-(2,3-dimethylphenyl)-5-nitro-pyrimidin-4-amine Openeye Name: 6-(benzimidazol-1-yl)-N-(2,3-dimethylphenyl)-5-nitro-pyrimidin-4-amine CAS Name: 6-(1-benzimidazolyl)-N-(2,3-dimethylphenyl)-5-nitro-4-pyrimidinamine IUPAC Name: 6-(benzimidazol-1-yl)-N-(2,3-dimethylphenyl)-5-nitropyrimidin-4-amine Traditional Name: [6-(benzimidazol-1-yl)-5-nitro-pyrimidin-4-yl]-(2,3-dimethylphenyl)amine Formula: C19H16N6O2 MolecularWeight: 360.36934

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC2=NC=NC(=C2[N+](=O)[O-])N3C=NC4=CC=CC=C43)C

Isomeric SMILES

CC1=C(C(=CC=C1)NC2=NC=NC(=C2[N+](=O)[O-])N3C=NC4=CC=CC=C43)C

InChI

InChI=1S/C19H16N6O2/c1-12-6-5-8-14(13(12)2)23-18-17(25(26)27)19(21-10-20-18)24-11-22-15-7-3-4-9-16(15)24/h3-11H,1-2H3,(H,20,21,23)