2-(4-chlorophenyl)carbothioylsulfanylethanoic acid

Systemtic Name: 2-(4-chlorophenyl)carbothioylsulfanylethanoic acid Openeye Name: 2-(4-chlorobenzenecarbothioyl)sulfanylacetic acid CAS Name: 2-[[(4-chlorophenyl)-sulfanylidenemethyl]thio]acetic acid IUPAC Name: 2-(4-chlorobenzenecarbothioyl)sulfanylacetic acid Traditional Name: 2-[(4-chlorothiobenzoyl)thio]acetic acid Formula: C9H7ClO2S2 MolecularWeight: 246.73368

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=S)SCC(=O)O)Cl

Isomeric SMILES

C1=CC(=CC=C1C(=S)SCC(=O)O)Cl

InChI

InChI=1S/C9H7ClO2S2/c10-7-3-1-6(2-4-7)9(13)14-5-8(11)12/h1-4H,5H2,(H,11,12)