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

Systemtic Name: 5-[2-[(4-chlorophenyl)methylsulfanyl]ethanoylamino]-2-methyl-benzoic acid Openeye Name: 5-[[2-[(4-chlorophenyl)methylsulfanyl]acetyl]amino]-2-methyl-benzoic acid CAS Name: 5-[[2-[(4-chlorophenyl)methylthio]-1-oxoethyl]amino]-2-methylbenzoic acid IUPAC Name: 5-[[2-[(4-chlorophenyl)methylsulfanyl]acetyl]amino]-2-methylbenzoic acid Traditional Name: 5-[[2-[(4-chlorobenzyl)thio]acetyl]amino]-2-methyl-benzoic acid Formula: C17H16ClNO3S MolecularWeight: 349.83184

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CSCC2=CC=C(C=C2)Cl)C(=O)O

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CSCC2=CC=C(C=C2)Cl)C(=O)O

InChI

InChI=1S/C17H16ClNO3S/c1-11-2-7-14(8-15(11)17(21)22)19-16(20)10-23-9-12-3-5-13(18)6-4-12/h2-8H,9-10H2,1H3,(H,19,20)(H,21,22)