3-[methylsulfanylcarbothioyl(phenyl)amino]propanoic acid

Systemtic Name: 3-[methylsulfanylcarbothioyl(phenyl)amino]propanoic acid Openeye Name: 3-(N-methylsulfanylcarbothioylanilino)propanoic acid CAS Name: 3-(N-[(methylthio)-sulfanylidenemethyl]anilino)propanoic acid IUPAC Name: 3-(N-methylsulfanylcarbothioylanilino)propanoic acid Traditional Name: 3-(N-(methylthio)carbothioylanilino)propionic acid Formula: C11H13NO2S2 MolecularWeight: 255.35642

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Descriptors Computed from Structure

Canonical SMILES:

CSC(=S)N(CCC(=O)O)C1=CC=CC=C1

Isomeric SMILES

CSC(=S)N(CCC(=O)O)C1=CC=CC=C1

InChI

InChI=1S/C11H13NO2S2/c1-16-11(15)12(8-7-10(13)14)9-5-3-2-4-6-9/h2-6H,7-8H2,1H3,(H,13,14)