4-[2-[2,6-bis(chloranyl)phenyl]sulfanylethanoylamino]-3-methyl-benzoic acid

Systemtic Name: 4-[2-[2,6-bis(chloranyl)phenyl]sulfanylethanoylamino]-3-methyl-benzoic acid Openeye Name: 4-[[2-(2,6-dichlorophenyl)sulfanylacetyl]amino]-3-methyl-benzoic acid CAS Name: 4-[[2-[(2,6-dichlorophenyl)thio]-1-oxoethyl]amino]-3-methylbenzoic acid IUPAC Name: 4-[[2-(2,6-dichlorophenyl)sulfanylacetyl]amino]-3-methylbenzoic acid Traditional Name: 4-[[2-[(2,6-dichlorophenyl)thio]acetyl]amino]-3-methyl-benzoic acid Formula: C16H13Cl2NO3S MolecularWeight: 370.25032

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)O)NC(=O)CSC2=C(C=CC=C2Cl)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)O)NC(=O)CSC2=C(C=CC=C2Cl)Cl

InChI

InChI=1S/C16H13Cl2NO3S/c1-9-7-10(16(21)22)5-6-13(9)19-14(20)8-23-15-11(17)3-2-4-12(15)18/h2-7H,8H2,1H3,(H,19,20)(H,21,22)