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

Systemtic Name: N-[[5-[(2,5-dimethylphenyl)methylsulfanyl]-4-ethyl-1,2,4-triazol-3-yl]methyl]-4-methyl-benzenesulfonamide Openeye Name: N-[[5-[(2,5-dimethylphenyl)methylsulfanyl]-4-ethyl-1,2,4-triazol-3-yl]methyl]-4-methyl-benzenesulfonamide CAS Name: N-[[5-[(2,5-dimethylphenyl)methylthio]-4-ethyl-1,2,4-triazol-3-yl]methyl]-4-methylbenzenesulfonamide IUPAC Name: N-[[5-[(2,5-dimethylphenyl)methylsulfanyl]-4-ethyl-1,2,4-triazol-3-yl]methyl]-4-methylbenzenesulfonamide Traditional Name: N-[[5-[(2,5-dimethylbenzyl)thio]-4-ethyl-1,2,4-triazol-3-yl]methyl]-4-methyl-benzenesulfonamide Formula: C21H26N4O2S2 MolecularWeight: 430.58674

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC2=C(C=CC(=C2)C)C)CNS(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCN1C(=NN=C1SCC2=C(C=CC(=C2)C)C)CNS(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C21H26N4O2S2/c1-5-25-20(13-22-29(26,27)19-10-7-15(2)8-11-19)23-24-21(25)28-14-18-12-16(3)6-9-17(18)4/h6-12,22H,5,13-14H2,1-4H3