5-[3-(4-bromophenyl)-1H-pyrazol-5-yl]-3-(3-nitrophenyl)-1,2,3-triazol-4-amine

Systemtic Name: 5-[3-(4-bromophenyl)-1H-pyrazol-5-yl]-3-(3-nitrophenyl)-1,2,3-triazol-4-amine Openeye Name: 5-[3-(4-bromophenyl)-1H-pyrazol-5-yl]-3-(3-nitrophenyl)triazol-4-amine CAS Name: 5-[3-(4-bromophenyl)-1H-pyrazol-5-yl]-3-(3-nitrophenyl)-4-triazolamine IUPAC Name: 5-[3-(4-bromophenyl)-1H-pyrazol-5-yl]-3-(3-nitrophenyl)triazol-4-amine Traditional Name: [5-[3-(4-bromophenyl)-1H-pyrazol-5-yl]-3-(3-nitrophenyl)triazol-4-yl]amine Formula: C17H12BrN7O2 MolecularWeight: 426.22688

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])N2C(=C(N=N2)C3=CC(=NN3)C4=CC=C(C=C4)Br)N

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])N2C(=C(N=N2)C3=CC(=NN3)C4=CC=C(C=C4)Br)N

InChI

InChI=1S/C17H12BrN7O2/c18-11-6-4-10(5-7-11)14-9-15(21-20-14)16-17(19)24(23-22-16)12-2-1-3-13(8-12)25(26)27/h1-9H,19H2,(H,20,21)