1-ethyl-5-methyl-3-[3-(trioxidanylsulfanyl)phenyl]-1,2,4-triazole

Systemtic Name: 1-ethyl-5-methyl-3-[3-(trioxidanylsulfanyl)phenyl]-1,2,4-triazole Openeye Name: 1-ethyl-5-methyl-3-[3-(trioxidanylsulfanyl)phenyl]-1,2,4-triazole CAS Name: 3-(1-ethyl-5-methyl-1,2,4-triazol-3-yl)benzenesulfenic acid hydroperoxy ester IUPAC Name: 1-ethyl-5-methyl-3-[3-(trioxidanylsulfanyl)phenyl]-1,2,4-triazole Traditional Name: 1-ethyl-5-methyl-3-[3-(trioxidanylthio)phenyl]-1,2,4-triazole Formula: C11H13N3O3S MolecularWeight: 267.30422

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NC(=N1)C2=CC(=CC=C2)SOOO)C

Isomeric SMILES

CCN1C(=NC(=N1)C2=CC(=CC=C2)SOOO)C

InChI

InChI=1S/C11H13N3O3S/c1-3-14-8(2)12-11(13-14)9-5-4-6-10(7-9)18-17-16-15/h4-7,15H,3H2,1-2H3