2-(3-methylphenyl)carbothioylsulfanylethanoic acid

Systemtic Name: 2-(3-methylphenyl)carbothioylsulfanylethanoic acid Openeye Name: 2-(3-methylbenzenecarbothioyl)sulfanylacetic acid CAS Name: 2-[[(3-methylphenyl)-sulfanylidenemethyl]thio]acetic acid IUPAC Name: 2-(3-methylbenzenecarbothioyl)sulfanylacetic acid Traditional Name: 2-[(3-methylthiobenzoyl)thio]acetic acid Formula: C10H10O2S2 MolecularWeight: 226.3152

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=S)SCC(=O)O

Isomeric SMILES

CC1=CC=CC(=C1)C(=S)SCC(=O)O

InChI

InChI=1S/C10H10O2S2/c1-7-3-2-4-8(5-7)10(13)14-6-9(11)12/h2-5H,6H2,1H3,(H,11,12)