4,6-dimethyl-N-[5-(2-nitrophenyl)-1H-1,2,4-triazol-3-yl]pyrimidin-2-amine

Systemtic Name: 4,6-dimethyl-N-[5-(2-nitrophenyl)-1H-1,2,4-triazol-3-yl]pyrimidin-2-amine Openeye Name: 4,6-dimethyl-N-[5-(2-nitrophenyl)-1H-1,2,4-triazol-3-yl]pyrimidin-2-amine CAS Name: 4,6-dimethyl-N-[5-(2-nitrophenyl)-1H-1,2,4-triazol-3-yl]-2-pyrimidinamine IUPAC Name: 4,6-dimethyl-N-[5-(2-nitrophenyl)-1H-1,2,4-triazol-3-yl]pyrimidin-2-amine Traditional Name: (4,6-dimethylpyrimidin-2-yl)-[5-(2-nitrophenyl)-1H-1,2,4-triazol-3-yl]amine Formula: C14H13N7O2 MolecularWeight: 311.29872

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)NC2=NNC(=N2)C3=CC=CC=C3[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=NC(=N1)NC2=NNC(=N2)C3=CC=CC=C3[N+](=O)[O-])C

InChI

InChI=1S/C14H13N7O2/c1-8-7-9(2)16-13(15-8)18-14-17-12(19-20-14)10-5-3-4-6-11(10)21(22)23/h3-7H,1-2H3,(H2,15,16,17,18,19,20)