4-[(2-methyl-5-nitro-1,2,4-triazol-3-yl)oxy]-1,1-bis(oxidanylidene)-2,5-diphenyl-thiophen-3-one

Systemtic Name: 4-[(2-methyl-5-nitro-1,2,4-triazol-3-yl)oxy]-1,1-bis(oxidanylidene)-2,5-diphenyl-thiophen-3-one Openeye Name: 4-[(2-methyl-5-nitro-1,2,4-triazol-3-yl)oxy]-1,1-dioxo-2,5-diphenyl-thiophen-3-one CAS Name: 4-[(2-methyl-5-nitro-1,2,4-triazol-3-yl)oxy]-1,1-dioxo-2,5-diphenyl-3-thiophenone IUPAC Name: 4-[(2-methyl-5-nitro-1,2,4-triazol-3-yl)oxy]-1,1-dioxo-2,5-diphenylthiophen-3-one Traditional Name: 1,1-diketo-4-[(2-methyl-5-nitro-1,2,4-triazol-3-yl)oxy]-2,5-diphenyl-thiophen-3-one Formula: C19H14N4O6S MolecularWeight: 426.40266

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NC(=N1)[N+](=O)[O-])OC2=C(S(=O)(=O)C(C2=O)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CN1C(=NC(=N1)[N+](=O)[O-])OC2=C(S(=O)(=O)C(C2=O)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C19H14N4O6S/c1-22-19(20-18(21-22)23(25)26)29-15-14(24)16(12-8-4-2-5-9-12)30(27,28)17(15)13-10-6-3-7-11-13/h2-11,16H,1H3