2-(2-aminocarbonyl-5-chloranyl-3-methyl-phenyl)sulfanylethanoic acid

Systemtic Name: 2-(2-aminocarbonyl-5-chloranyl-3-methyl-phenyl)sulfanylethanoic acid Openeye Name: 2-(2-carbamoyl-5-chloro-3-methyl-phenyl)sulfanylacetic acid CAS Name: 2-[(2-carbamoyl-5-chloro-3-methylphenyl)thio]acetic acid IUPAC Name: 2-(2-carbamoyl-5-chloro-3-methylphenyl)sulfanylacetic acid Traditional Name: 2-[(2-carbamoyl-5-chloro-3-methyl-phenyl)thio]acetic acid Formula: C10H10ClNO3S MolecularWeight: 259.7093

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1C(=O)N)SCC(=O)O)Cl

Isomeric SMILES

CC1=CC(=CC(=C1C(=O)N)SCC(=O)O)Cl

InChI

InChI=1S/C10H10ClNO3S/c1-5-2-6(11)3-7(9(5)10(12)15)16-4-8(13)14/h2-3H,4H2,1H3,(H2,12,15)(H,13,14)