3-chloranyl-2-methyl-N-[3-methyl-4-(trioxidanylsulfanyl)phenyl]propanethioamide

Systemtic Name: 3-chloranyl-2-methyl-N-[3-methyl-4-(trioxidanylsulfanyl)phenyl]propanethioamide Openeye Name: 3-chloro-2-methyl-N-[3-methyl-4-(trioxidanylsulfanyl)phenyl]propanethioamide CAS Name: 4-[(3-chloro-2-methyl-1-sulfanylidenepropyl)amino]-2-methylbenzenesulfenic acid hydroperoxy ester IUPAC Name: 3-chloro-2-methyl-N-[3-methyl-4-(trioxidanylsulfanyl)phenyl]propanethioamide Traditional Name: 3-chloro-2-methyl-N-[3-methyl-4-(trioxidanylthio)phenyl]thiopropionamide Formula: C11H14ClNO3S2 MolecularWeight: 307.81676

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H14ClNO3S2/c1-7-5-9(13-11(17)8(2)6-12)3-4-10(7)18-16-15-14/h3-5,8,14H,6H2,1-2H3,(H,13,17)