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

Systemtic Name: 4-[2-[[4-(2-methoxyethyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanyl]ethoxy]benzenesulfonamide Openeye Name: 4-[2-[[4-(2-methoxyethyl)-5-(4-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]ethoxy]benzenesulfonamide CAS Name: 4-[2-[[4-(2-methoxyethyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]thio]ethoxy]benzenesulfonamide IUPAC Name: 4-[2-[[4-(2-methoxyethyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanyl]ethoxy]benzenesulfonamide Traditional Name: 4-[2-[[4-(2-methoxyethyl)-5-(4-pyridyl)-1,2,4-triazol-3-yl]thio]ethoxy]benzenesulfonamide Formula: C18H21N5O4S2 MolecularWeight: 435.52044

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1C(=NN=C1SCCOC2=CC=C(C=C2)S(=O)(=O)N)C3=CC=NC=C3

Isomeric SMILES

COCCN1C(=NN=C1SCCOC2=CC=C(C=C2)S(=O)(=O)N)C3=CC=NC=C3

InChI

InChI=1S/C18H21N5O4S2/c1-26-11-10-23-17(14-6-8-20-9-7-14)21-22-18(23)28-13-12-27-15-2-4-16(5-3-15)29(19,24)25/h2-9H,10-13H2,1H3,(H2,19,24,25)