4-[2-[[4-cyclopropyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]ethoxy]benzenesulfonamide

Systemtic Name: 4-[2-[[4-cyclopropyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]ethoxy]benzenesulfonamide Openeye Name: 4-[2-[[4-cyclopropyl-5-(2-thienylmethyl)-1,2,4-triazol-3-yl]sulfanyl]ethoxy]benzenesulfonamide CAS Name: 4-[2-[[4-cyclopropyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]thio]ethoxy]benzenesulfonamide IUPAC Name: 4-[2-[[4-cyclopropyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]ethoxy]benzenesulfonamide Traditional Name: 4-[2-[[4-cyclopropyl-5-(2-thenyl)-1,2,4-triazol-3-yl]thio]ethoxy]benzenesulfonamide Formula: C18H20N4O3S3 MolecularWeight: 436.5714

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C(=NN=C2SCCOC3=CC=C(C=C3)S(=O)(=O)N)CC4=CC=CS4

Isomeric SMILES

C1CC1N2C(=NN=C2SCCOC3=CC=C(C=C3)S(=O)(=O)N)CC4=CC=CS4

InChI

InChI=1S/C18H20N4O3S3/c19-28(23,24)16-7-5-14(6-8-16)25-9-11-27-18-21-20-17(22(18)13-3-4-13)12-15-2-1-10-26-15/h1-2,5-8,10,13H,3-4,9,11-12H2,(H2,19,23,24)