4-[2-[[4-ethyl-5-(phenylmethyl)-1,2,4-triazol-3-yl]sulfanyl]ethoxy]benzenesulfonamide

Systemtic Name: 4-[2-[[4-ethyl-5-(phenylmethyl)-1,2,4-triazol-3-yl]sulfanyl]ethoxy]benzenesulfonamide Openeye Name: 4-[2-[(5-benzyl-4-ethyl-1,2,4-triazol-3-yl)sulfanyl]ethoxy]benzenesulfonamide CAS Name: 4-[2-[[4-ethyl-5-(phenylmethyl)-1,2,4-triazol-3-yl]thio]ethoxy]benzenesulfonamide IUPAC Name: 4-[2-[(5-benzyl-4-ethyl-1,2,4-triazol-3-yl)sulfanyl]ethoxy]benzenesulfonamide Traditional Name: 4-[2-[(5-benzyl-4-ethyl-1,2,4-triazol-3-yl)thio]ethoxy]benzenesulfonamide Formula: C19H22N4O3S2 MolecularWeight: 418.53298

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCCOC2=CC=C(C=C2)S(=O)(=O)N)CC3=CC=CC=C3

Isomeric SMILES

CCN1C(=NN=C1SCCOC2=CC=C(C=C2)S(=O)(=O)N)CC3=CC=CC=C3

InChI

InChI=1S/C19H22N4O3S2/c1-2-23-18(14-15-6-4-3-5-7-15)21-22-19(23)27-13-12-26-16-8-10-17(11-9-16)28(20,24)25/h3-11H,2,12-14H2,1H3,(H2,20,24,25)