2-[(3-aminocarbonylphenyl)methylsulfanyl]ethanoic acid

Systemtic Name: 2-[(3-aminocarbonylphenyl)methylsulfanyl]ethanoic acid Openeye Name: 2-[(3-carbamoylphenyl)methylsulfanyl]acetic acid CAS Name: 2-[(3-carbamoylphenyl)methylthio]acetic acid IUPAC Name: 2-[(3-carbamoylphenyl)methylsulfanyl]acetic acid Traditional Name: 2-[(3-carbamoylbenzyl)thio]acetic acid Formula: C10H11NO3S MolecularWeight: 225.26424

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)CSCC(=O)O)C(=O)N

Isomeric SMILES

C1=CC(=CC(=C1)CSCC(=O)O)C(=O)N

InChI

InChI=1S/C10H11NO3S/c11-10(14)8-3-1-2-7(4-8)5-15-6-9(12)13/h1-4H,5-6H2,(H2,11,14)(H,12,13)