2-[2-(4-chlorophenyl)sulfanylethanoylamino]-5-methyl-benzoic acid

Systemtic Name: 2-[2-(4-chlorophenyl)sulfanylethanoylamino]-5-methyl-benzoic acid Openeye Name: 2-[[2-(4-chlorophenyl)sulfanylacetyl]amino]-5-methyl-benzoic acid CAS Name: 2-[[2-[(4-chlorophenyl)thio]-1-oxoethyl]amino]-5-methylbenzoic acid IUPAC Name: 2-[[2-(4-chlorophenyl)sulfanylacetyl]amino]-5-methylbenzoic acid Traditional Name: 2-[[2-[(4-chlorophenyl)thio]acetyl]amino]-5-methyl-benzoic acid Formula: C16H14ClNO3S MolecularWeight: 335.80526

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)CSC2=CC=C(C=C2)Cl)C(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)CSC2=CC=C(C=C2)Cl)C(=O)O

InChI

InChI=1S/C16H14ClNO3S/c1-10-2-7-14(13(8-10)16(20)21)18-15(19)9-22-12-5-3-11(17)4-6-12/h2-8H,9H2,1H3,(H,18,19)(H,20,21)