2-[(3-chlorophenyl)carbamothioylsulfanyl]ethanoic acid

Systemtic Name: 2-[(3-chlorophenyl)carbamothioylsulfanyl]ethanoic acid Openeye Name: 2-[(3-chlorophenyl)carbamothioylsulfanyl]acetic acid CAS Name: 2-[[(3-chloroanilino)-sulfanylidenemethyl]thio]acetic acid IUPAC Name: 2-[(3-chlorophenyl)carbamothioylsulfanyl]acetic acid Traditional Name: 2-[(3-chlorophenyl)thiocarbamoylthio]acetic acid Formula: C9H8ClNO2S2 MolecularWeight: 261.74832

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)NC(=S)SCC(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)Cl)NC(=S)SCC(=O)O

InChI

InChI=1S/C9H8ClNO2S2/c10-6-2-1-3-7(4-6)11-9(14)15-5-8(12)13/h1-4H,5H2,(H,11,14)(H,12,13)