4-chloranyl-2-[2-(3,4-dimethylphenyl)sulfanylethanoylamino]benzoic acid

Systemtic Name: 4-chloranyl-2-[2-(3,4-dimethylphenyl)sulfanylethanoylamino]benzoic acid Openeye Name: 4-chloro-2-[[2-(3,4-dimethylphenyl)sulfanylacetyl]amino]benzoic acid CAS Name: 4-chloro-2-[[2-[(3,4-dimethylphenyl)thio]-1-oxoethyl]amino]benzoic acid IUPAC Name: 4-chloro-2-[[2-(3,4-dimethylphenyl)sulfanylacetyl]amino]benzoic acid Traditional Name: 4-chloro-2-[[2-[(3,4-dimethylphenyl)thio]acetyl]amino]benzoic acid Formula: C17H16ClNO3S MolecularWeight: 349.83184

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)SCC(=O)NC2=C(C=CC(=C2)Cl)C(=O)O)C

Isomeric SMILES

CC1=C(C=C(C=C1)SCC(=O)NC2=C(C=CC(=C2)Cl)C(=O)O)C

InChI

InChI=1S/C17H16ClNO3S/c1-10-3-5-13(7-11(10)2)23-9-16(20)19-15-8-12(18)4-6-14(15)17(21)22/h3-8H,9H2,1-2H3,(H,19,20)(H,21,22)