N-[3-methyl-5-(trioxidanylsulfanyl)phenyl]ethanethioamide

Systemtic Name: N-[3-methyl-5-(trioxidanylsulfanyl)phenyl]ethanethioamide Openeye Name: N-[3-methyl-5-(trioxidanylsulfanyl)phenyl]thioacetamide CAS Name: 3-methyl-5-(1-sulfanylideneethylamino)benzenesulfenic acid hydroperoxy ester IUPAC Name: N-[3-methyl-5-(trioxidanylsulfanyl)phenyl]ethanethioamide Traditional Name: N-[3-methyl-5-(trioxidanylthio)phenyl]thioacetamide Formula: C9H11NO3S2 MolecularWeight: 245.31854

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)SOOO)NC(=S)C

Isomeric SMILES

CC1=CC(=CC(=C1)SOOO)NC(=S)C

InChI

InChI=1S/C9H11NO3S2/c1-6-3-8(10-7(2)14)5-9(4-6)15-13-12-11/h3-5,11H,1-2H3,(H,10,14)