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

Systemtic Name: N-(3-methylsulfanyl-1H-1,2,4-triazol-5-yl)-4-propyl-benzenesulfonamide Openeye Name: N-(3-methylsulfanyl-1H-1,2,4-triazol-5-yl)-4-propyl-benzenesulfonamide CAS Name: N-[3-(methylthio)-1H-1,2,4-triazol-5-yl]-4-propylbenzenesulfonamide IUPAC Name: N-(3-methylsulfanyl-1H-1,2,4-triazol-5-yl)-4-propylbenzenesulfonamide Traditional Name: N-[3-(methylthio)-1H-1,2,4-triazol-5-yl]-4-propyl-benzenesulfonamide Formula: C12H16N4O2S2 MolecularWeight: 312.41104

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)S(=O)(=O)NC2=NC(=NN2)SC

Isomeric SMILES

CCCC1=CC=C(C=C1)S(=O)(=O)NC2=NC(=NN2)SC

InChI

InChI=1S/C12H16N4O2S2/c1-3-4-9-5-7-10(8-6-9)20(17,18)16-11-13-12(19-2)15-14-11/h5-8H,3-4H2,1-2H3,(H2,13,14,15,16)