4-iodanyl-N-(3-methylsulfanyl-1H-1,2,4-triazol-5-yl)benzenesulfonamide

Systemtic Name: 4-iodanyl-N-(3-methylsulfanyl-1H-1,2,4-triazol-5-yl)benzenesulfonamide Openeye Name: 4-iodo-N-(3-methylsulfanyl-1H-1,2,4-triazol-5-yl)benzenesulfonamide CAS Name: 4-iodo-N-[3-(methylthio)-1H-1,2,4-triazol-5-yl]benzenesulfonamide IUPAC Name: 4-iodo-N-(3-methylsulfanyl-1H-1,2,4-triazol-5-yl)benzenesulfonamide Traditional Name: 4-iodo-N-[3-(methylthio)-1H-1,2,4-triazol-5-yl]benzenesulfonamide Formula: C9H9IN4O2S2 MolecularWeight: 396.22783

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NNC(=N1)NS(=O)(=O)C2=CC=C(C=C2)I

Isomeric SMILES

CSC1=NNC(=N1)NS(=O)(=O)C2=CC=C(C=C2)I

InChI

InChI=1S/C9H9IN4O2S2/c1-17-9-11-8(12-13-9)14-18(15,16)7-4-2-6(10)3-5-7/h2-5H,1H3,(H2,11,12,13,14)