1-[2-[1-(3-nitrophenyl)ethylamino]pyrimidin-4-yl]benzimidazol-5-amine

Systemtic Name: 1-[2-[1-(3-nitrophenyl)ethylamino]pyrimidin-4-yl]benzimidazol-5-amine Openeye Name: 1-[2-[1-(3-nitrophenyl)ethylamino]pyrimidin-4-yl]benzimidazol-5-amine CAS Name: 1-[2-[1-(3-nitrophenyl)ethylamino]-4-pyrimidinyl]-5-benzimidazolamine IUPAC Name: 1-[2-[1-(3-nitrophenyl)ethylamino]pyrimidin-4-yl]benzimidazol-5-amine Traditional Name: [4-(5-aminobenzimidazol-1-yl)pyrimidin-2-yl]-[1-(3-nitrophenyl)ethyl]amine Formula: C19H17N7O2 MolecularWeight: 375.38398

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=CC=C1)[N+](=O)[O-])NC2=NC=CC(=N2)N3C=NC4=C3C=CC(=C4)N

Isomeric SMILES

CC(C1=CC(=CC=C1)[N+](=O)[O-])NC2=NC=CC(=N2)N3C=NC4=C3C=CC(=C4)N

InChI

InChI=1S/C19H17N7O2/c1-12(13-3-2-4-15(9-13)26(27)28)23-19-21-8-7-18(24-19)25-11-22-16-10-14(20)5-6-17(16)25/h2-12H,20H2,1H3,(H,21,23,24)