2-[(3-fluoranyl-4-methyl-phenyl)carbonylamino]-3-sulfanyl-propanoic acid

Systemtic Name: 2-[(3-fluoranyl-4-methyl-phenyl)carbonylamino]-3-sulfanyl-propanoic acid Openeye Name: 2-[(3-fluoro-4-methyl-benzoyl)amino]-3-sulfanyl-propanoic acid CAS Name: 2-[[(3-fluoro-4-methylphenyl)-oxomethyl]amino]-3-mercaptopropanoic acid IUPAC Name: 2-[(3-fluoro-4-methylbenzoyl)amino]-3-sulfanylpropanoic acid Traditional Name: 2-[(3-fluoro-4-methyl-benzoyl)amino]-3-mercapto-propionic acid Formula: C11H12FNO3S MolecularWeight: 257.281283

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC(CS)C(=O)O)F

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC(CS)C(=O)O)F

InChI

InChI=1S/C11H12FNO3S/c1-6-2-3-7(4-8(6)12)10(14)13-9(5-17)11(15)16/h2-4,9,17H,5H2,1H3,(H,13,14)(H,15,16)