3-[(5-cyclopropyl-1-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]-N,N-dimethyl-benzenesulfonamide

Systemtic Name: 3-[(5-cyclopropyl-1-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]-N,N-dimethyl-benzenesulfonamide Openeye Name: 3-[(5-cyclopropyl-1-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]-N,N-dimethyl-benzenesulfonamide CAS Name: 3-[[(5-cyclopropyl-1-phenyl-1,2,4-triazol-3-yl)thio]methyl]-N,N-dimethylbenzenesulfonamide IUPAC Name: 3-[(5-cyclopropyl-1-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]-N,N-dimethylbenzenesulfonamide Traditional Name: 3-[[(5-cyclopropyl-1-phenyl-1,2,4-triazol-3-yl)thio]methyl]-N,N-dimethyl-benzenesulfonamide Formula: C20H22N4O2S2 MolecularWeight: 414.54428

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC=CC(=C1)CSC2=NN(C(=N2)C3CC3)C4=CC=CC=C4

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC=CC(=C1)CSC2=NN(C(=N2)C3CC3)C4=CC=CC=C4

InChI

InChI=1S/C20H22N4O2S2/c1-23(2)28(25,26)18-10-6-7-15(13-18)14-27-20-21-19(16-11-12-16)24(22-20)17-8-4-3-5-9-17/h3-10,13,16H,11-12,14H2,1-2H3