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

Systemtic Name: 4-[3-(5-chloranyl-2-methoxy-phenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]benzenesulfonamide Openeye Name: 4-[3-(5-chloro-2-methoxy-phenyl)-5-thioxo-1H-1,2,4-triazol-4-yl]benzenesulfonamide CAS Name: 4-[3-(5-chloro-2-methoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]benzenesulfonamide IUPAC Name: 4-[3-(5-chloro-2-methoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]benzenesulfonamide Traditional Name: 4-[3-(5-chloro-2-methoxy-phenyl)-5-thioxo-1H-1,2,4-triazol-4-yl]benzenesulfonamide Formula: C15H13ClN4O3S2 MolecularWeight: 396.87172

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)C2=NNC(=S)N2C3=CC=C(C=C3)S(=O)(=O)N

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)C2=NNC(=S)N2C3=CC=C(C=C3)S(=O)(=O)N

InChI

InChI=1S/C15H13ClN4O3S2/c1-23-13-7-2-9(16)8-12(13)14-18-19-15(24)20(14)10-3-5-11(6-4-10)25(17,21)22/h2-8H,1H3,(H,19,24)(H2,17,21,22)