3-[2-[(3,4-dichlorophenyl)methylsulfanyl]ethanoylamino]-2-methyl-benzoic acid

Systemtic Name: 3-[2-[(3,4-dichlorophenyl)methylsulfanyl]ethanoylamino]-2-methyl-benzoic acid Openeye Name: 3-[[2-[(3,4-dichlorophenyl)methylsulfanyl]acetyl]amino]-2-methyl-benzoic acid CAS Name: 3-[[2-[(3,4-dichlorophenyl)methylthio]-1-oxoethyl]amino]-2-methylbenzoic acid IUPAC Name: 3-[[2-[(3,4-dichlorophenyl)methylsulfanyl]acetyl]amino]-2-methylbenzoic acid Traditional Name: 3-[[2-[(3,4-dichlorobenzyl)thio]acetyl]amino]-2-methyl-benzoic acid Formula: C17H15Cl2NO3S MolecularWeight: 384.2769

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1NC(=O)CSCC2=CC(=C(C=C2)Cl)Cl)C(=O)O

Isomeric SMILES

CC1=C(C=CC=C1NC(=O)CSCC2=CC(=C(C=C2)Cl)Cl)C(=O)O

InChI

InChI=1S/C17H15Cl2NO3S/c1-10-12(17(22)23)3-2-4-15(10)20-16(21)9-24-8-11-5-6-13(18)14(19)7-11/h2-7H,8-9H2,1H3,(H,20,21)(H,22,23)