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

Systemtic Name: 4-[(3-cyclopropyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)methyl]benzenesulfonamide Openeye Name: 4-[(3-cyclopropyl-5-thioxo-1H-1,2,4-triazol-4-yl)methyl]benzenesulfonamide CAS Name: 4-[(3-cyclopropyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)methyl]benzenesulfonamide IUPAC Name: 4-[(3-cyclopropyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)methyl]benzenesulfonamide Traditional Name: 4-[(3-cyclopropyl-5-thioxo-1H-1,2,4-triazol-4-yl)methyl]benzenesulfonamide Formula: C12H14N4O2S2 MolecularWeight: 310.39516

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NNC(=S)N2CC3=CC=C(C=C3)S(=O)(=O)N

Isomeric SMILES

C1CC1C2=NNC(=S)N2CC3=CC=C(C=C3)S(=O)(=O)N

InChI

InChI=1S/C12H14N4O2S2/c13-20(17,18)10-5-1-8(2-6-10)7-16-11(9-3-4-9)14-15-12(16)19/h1-2,5-6,9H,3-4,7H2,(H,15,19)(H2,13,17,18)