2-dodecyl-N-(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)benzenesulfonamide

Systemtic Name: 2-dodecyl-N-(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)benzenesulfonamide Openeye Name: 2-dodecyl-N-(2-thioxo-3H-1,3,4-thiadiazol-5-yl)benzenesulfonamide CAS Name: 2-dodecyl-N-(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)benzenesulfonamide IUPAC Name: 2-dodecyl-N-(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)benzenesulfonamide Traditional Name: 2-lauryl-N-(2-thioxo-3H-1,3,4-thiadiazol-5-yl)benzenesulfonamide Formula: C20H31N3O2S3 MolecularWeight: 441.67404

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=CC=CC=C1S(=O)(=O)NC2=NNC(=S)S2

Isomeric SMILES

CCCCCCCCCCCCC1=CC=CC=C1S(=O)(=O)NC2=NNC(=S)S2

InChI

InChI=1S/C20H31N3O2S3/c1-2-3-4-5-6-7-8-9-10-11-14-17-15-12-13-16-18(17)28(24,25)23-19-21-22-20(26)27-19/h12-13,15-16H,2-11,14H2,1H3,(H,21,23)(H,22,26)