(2-nitrophenyl)-[3-(2-nitrophenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]methanone

Systemtic Name: (2-nitrophenyl)-[3-(2-nitrophenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]methanone Openeye Name: (2-nitrophenyl)-[3-(2-nitrophenyl)-5-thioxo-1H-1,2,4-triazol-4-yl]methanone CAS Name: (2-nitrophenyl)-[3-(2-nitrophenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]methanone IUPAC Name: (2-nitrophenyl)-[3-(2-nitrophenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]methanone Traditional Name: (2-nitrophenyl)-[3-(2-nitrophenyl)-5-thioxo-1H-1,2,4-triazol-4-yl]methanone Formula: C15H9N5O5S MolecularWeight: 371.32746

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=NNC(=S)N2C(=O)C3=CC=CC=C3[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)C2=NNC(=S)N2C(=O)C3=CC=CC=C3[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C15H9N5O5S/c21-14(10-6-2-4-8-12(10)20(24)25)18-13(16-17-15(18)26)9-5-1-3-7-11(9)19(22)23/h1-8H,(H,17,26)