N-[(4-ethyl-5-methylsulfanyl-1,2,4-triazol-3-yl)methyl]-4-methyl-benzenesulfonamide

Systemtic Name: N-[(4-ethyl-5-methylsulfanyl-1,2,4-triazol-3-yl)methyl]-4-methyl-benzenesulfonamide Openeye Name: N-[(4-ethyl-5-methylsulfanyl-1,2,4-triazol-3-yl)methyl]-4-methyl-benzenesulfonamide CAS Name: N-[[4-ethyl-5-(methylthio)-1,2,4-triazol-3-yl]methyl]-4-methylbenzenesulfonamide IUPAC Name: N-[(4-ethyl-5-methylsulfanyl-1,2,4-triazol-3-yl)methyl]-4-methylbenzenesulfonamide Traditional Name: N-[[4-ethyl-5-(methylthio)-1,2,4-triazol-3-yl]methyl]-4-methyl-benzenesulfonamide Formula: C13H18N4O2S2 MolecularWeight: 326.43762

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SC)CNS(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCN1C(=NN=C1SC)CNS(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C13H18N4O2S2/c1-4-17-12(15-16-13(17)20-3)9-14-21(18,19)11-7-5-10(2)6-8-11/h5-8,14H,4,9H2,1-3H3