3-[4-(2,5-dimethoxyphenyl)-5-propylsulfanyl-1,2,4-triazol-3-yl]-N,N-dimethyl-benzenesulfonamide

Systemtic Name: 3-[4-(2,5-dimethoxyphenyl)-5-propylsulfanyl-1,2,4-triazol-3-yl]-N,N-dimethyl-benzenesulfonamide Openeye Name: 3-[4-(2,5-dimethoxyphenyl)-5-propylsulfanyl-1,2,4-triazol-3-yl]-N,N-dimethyl-benzenesulfonamide CAS Name: 3-[4-(2,5-dimethoxyphenyl)-5-(propylthio)-1,2,4-triazol-3-yl]-N,N-dimethylbenzenesulfonamide IUPAC Name: 3-[4-(2,5-dimethoxyphenyl)-5-propylsulfanyl-1,2,4-triazol-3-yl]-N,N-dimethylbenzenesulfonamide Traditional Name: 3-[4-(2,5-dimethoxyphenyl)-5-(propylthio)-1,2,4-triazol-3-yl]-N,N-dimethyl-benzenesulfonamide Formula: C21H26N4O4S2 MolecularWeight: 462.58554

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=NN=C(N1C2=C(C=CC(=C2)OC)OC)C3=CC(=CC=C3)S(=O)(=O)N(C)C

Isomeric SMILES

CCCSC1=NN=C(N1C2=C(C=CC(=C2)OC)OC)C3=CC(=CC=C3)S(=O)(=O)N(C)C

InChI

InChI=1S/C21H26N4O4S2/c1-6-12-30-21-23-22-20(15-8-7-9-17(13-15)31(26,27)24(2)3)25(21)18-14-16(28-4)10-11-19(18)29-5/h7-11,13-14H,6,12H2,1-5H3