4-ethoxy-N-[4-oxidanyl-3-(1H-1,2,4-triazol-5-ylsulfanyl)phenyl]benzenesulfonamide

Systemtic Name: 4-ethoxy-N-[4-oxidanyl-3-(1H-1,2,4-triazol-5-ylsulfanyl)phenyl]benzenesulfonamide Openeye Name: 4-ethoxy-N-[4-hydroxy-3-(1H-1,2,4-triazol-5-ylsulfanyl)phenyl]benzenesulfonamide CAS Name: 4-ethoxy-N-[4-hydroxy-3-(1H-1,2,4-triazol-5-ylthio)phenyl]benzenesulfonamide IUPAC Name: 4-ethoxy-N-[4-hydroxy-3-(1H-1,2,4-triazol-5-ylsulfanyl)phenyl]benzenesulfonamide Traditional Name: 4-ethoxy-N-[4-hydroxy-3-(1H-1,2,4-triazol-5-ylthio)phenyl]benzenesulfonamide Formula: C16H16N4O4S2 MolecularWeight: 392.45264

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)S(=O)(=O)NC2=CC(=C(C=C2)O)SC3=NC=NN3

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)NC2=CC(=C(C=C2)O)SC3=NC=NN3

InChI

InChI=1S/C16H16N4O4S2/c1-2-24-12-4-6-13(7-5-12)26(22,23)20-11-3-8-14(21)15(9-11)25-16-17-10-18-19-16/h3-10,20-21H,2H2,1H3,(H,17,18,19)