4-(benzimidazol-1-yl)-N-[(1S)-1-(3-nitrophenyl)ethyl]pyrimidin-2-amine

Systemtic Name: 4-(benzimidazol-1-yl)-N-[(1S)-1-(3-nitrophenyl)ethyl]pyrimidin-2-amine Openeye Name: 4-(benzimidazol-1-yl)-N-[(1S)-1-(3-nitrophenyl)ethyl]pyrimidin-2-amine CAS Name: 4-(1-benzimidazolyl)-N-[(1S)-1-(3-nitrophenyl)ethyl]-2-pyrimidinamine IUPAC Name: 4-(benzimidazol-1-yl)-N-[(1S)-1-(3-nitrophenyl)ethyl]pyrimidin-2-amine Traditional Name: [4-(benzimidazol-1-yl)pyrimidin-2-yl]-[(1S)-1-(3-nitrophenyl)ethyl]amine Formula: C19H16N6O2 MolecularWeight: 360.36934

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=CC=C1)[N+](=O)[O-])NC2=NC=CC(=N2)N3C=NC4=CC=CC=C43

Isomeric SMILES

C[C@@H](C1=CC(=CC=C1)[N+](=O)[O-])NC2=NC=CC(=N2)N3C=NC4=CC=CC=C43

InChI

InChI=1S/C19H16N6O2/c1-13(14-5-4-6-15(11-14)25(26)27)22-19-20-10-9-18(23-19)24-12-21-16-7-2-3-8-17(16)24/h2-13H,1H3,(H,20,22,23)/t13-/m0/s1