4-[2-(2-fluorophenyl)sulfanylethanoylamino]-3-methyl-benzoic acid

Systemtic Name: 4-[2-(2-fluorophenyl)sulfanylethanoylamino]-3-methyl-benzoic acid Openeye Name: 4-[[2-(2-fluorophenyl)sulfanylacetyl]amino]-3-methyl-benzoic acid CAS Name: 4-[[2-[(2-fluorophenyl)thio]-1-oxoethyl]amino]-3-methylbenzoic acid IUPAC Name: 4-[[2-(2-fluorophenyl)sulfanylacetyl]amino]-3-methylbenzoic acid Traditional Name: 4-[[2-[(2-fluorophenyl)thio]acetyl]amino]-3-methyl-benzoic acid Formula: C16H14FNO3S MolecularWeight: 319.350663

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)O)NC(=O)CSC2=CC=CC=C2F

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)O)NC(=O)CSC2=CC=CC=C2F

InChI

InChI=1S/C16H14FNO3S/c1-10-8-11(16(20)21)6-7-13(10)18-15(19)9-22-14-5-3-2-4-12(14)17/h2-8H,9H2,1H3,(H,18,19)(H,20,21)