4-[2-[[5-(4-tert-butylphenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]ethoxy]benzenesulfonamide

Systemtic Name: 4-[2-[[5-(4-tert-butylphenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]ethoxy]benzenesulfonamide Openeye Name: 4-[2-[[5-(4-tert-butylphenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]ethoxy]benzenesulfonamide CAS Name: 4-[2-[[5-(4-tert-butylphenyl)-4-methyl-1,2,4-triazol-3-yl]thio]ethoxy]benzenesulfonamide IUPAC Name: 4-[2-[[5-(4-tert-butylphenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]ethoxy]benzenesulfonamide Traditional Name: 4-[2-[[5-(4-tert-butylphenyl)-4-methyl-1,2,4-triazol-3-yl]thio]ethoxy]benzenesulfonamide Formula: C21H26N4O3S2 MolecularWeight: 446.58614

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=NN=C(N2C)SCCOC3=CC=C(C=C3)S(=O)(=O)N

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=NN=C(N2C)SCCOC3=CC=C(C=C3)S(=O)(=O)N

InChI

InChI=1S/C21H26N4O3S2/c1-21(2,3)16-7-5-15(6-8-16)19-23-24-20(25(19)4)29-14-13-28-17-9-11-18(12-10-17)30(22,26)27/h5-12H,13-14H2,1-4H3,(H2,22,26,27)