4-[2-[[4-(2-thiophen-2-ylethyl)-1,2,4-triazol-3-yl]sulfanyl]ethoxy]benzenesulfonamide

Systemtic Name: 4-[2-[[4-(2-thiophen-2-ylethyl)-1,2,4-triazol-3-yl]sulfanyl]ethoxy]benzenesulfonamide Openeye Name: 4-[2-[[4-[2-(2-thienyl)ethyl]-1,2,4-triazol-3-yl]sulfanyl]ethoxy]benzenesulfonamide CAS Name: 4-[2-[[4-(2-thiophen-2-ylethyl)-1,2,4-triazol-3-yl]thio]ethoxy]benzenesulfonamide IUPAC Name: 4-[2-[[4-(2-thiophen-2-ylethyl)-1,2,4-triazol-3-yl]sulfanyl]ethoxy]benzenesulfonamide Traditional Name: 4-[2-[[4-[2-(2-thienyl)ethyl]-1,2,4-triazol-3-yl]thio]ethoxy]benzenesulfonamide Formula: C16H18N4O3S3 MolecularWeight: 410.53412

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)CCN2C=NN=C2SCCOC3=CC=C(C=C3)S(=O)(=O)N

Isomeric SMILES

C1=CSC(=C1)CCN2C=NN=C2SCCOC3=CC=C(C=C3)S(=O)(=O)N

InChI

InChI=1S/C16H18N4O3S3/c17-26(21,22)15-5-3-13(4-6-15)23-9-11-25-16-19-18-12-20(16)8-7-14-2-1-10-24-14/h1-6,10,12H,7-9,11H2,(H2,17,21,22)