N-[(4-phenyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)methyl]benzenesulfonamide

Systemtic Name: N-[(4-phenyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)methyl]benzenesulfonamide Openeye Name: N-[(4-phenyl-5-thioxo-1H-1,2,4-triazol-3-yl)methyl]benzenesulfonamide CAS Name: N-[(4-phenyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)methyl]benzenesulfonamide IUPAC Name: N-[(4-phenyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)methyl]benzenesulfonamide Traditional Name: N-[(4-phenyl-5-thioxo-1H-1,2,4-triazol-3-yl)methyl]benzenesulfonamide Formula: C15H14N4O2S2 MolecularWeight: 346.42726

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=NNC2=S)CNS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)N2C(=NNC2=S)CNS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C15H14N4O2S2/c20-23(21,13-9-5-2-6-10-13)16-11-14-17-18-15(22)19(14)12-7-3-1-4-8-12/h1-10,16H,11H2,(H,18,22)