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

Systemtic Name: N-[4-[4-(4-methoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-3-yl]phenyl]-4-methyl-benzenesulfonamide Openeye Name: N-[4-[4-(4-methoxyphenyl)-5-thioxo-1H-1,2,4-triazol-3-yl]phenyl]-4-methyl-benzenesulfonamide CAS Name: N-[4-[4-(4-methoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-3-yl]phenyl]-4-methylbenzenesulfonamide IUPAC Name: N-[4-[4-(4-methoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-3-yl]phenyl]-4-methylbenzenesulfonamide Traditional Name: N-[4-[4-(4-methoxyphenyl)-5-thioxo-1H-1,2,4-triazol-3-yl]phenyl]-4-methyl-benzenesulfonamide Formula: C22H20N4O3S2 MolecularWeight: 452.5492

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C3=NNC(=S)N3C4=CC=C(C=C4)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C3=NNC(=S)N3C4=CC=C(C=C4)OC

InChI

InChI=1S/C22H20N4O3S2/c1-15-3-13-20(14-4-15)31(27,28)25-17-7-5-16(6-8-17)21-23-24-22(30)26(21)18-9-11-19(29-2)12-10-18/h3-14,25H,1-2H3,(H,24,30)