2,4-bis(chloranyl)-6-[2-(2-methylphenyl)sulfanylethanoylamino]benzoic acid

Systemtic Name: 2,4-bis(chloranyl)-6-[2-(2-methylphenyl)sulfanylethanoylamino]benzoic acid Openeye Name: 2,4-dichloro-6-[[2-(o-tolylsulfanyl)acetyl]amino]benzoic acid CAS Name: 2,4-dichloro-6-[[2-[(2-methylphenyl)thio]-1-oxoethyl]amino]benzoic acid IUPAC Name: 2,4-dichloro-6-[[2-(2-methylphenyl)sulfanylacetyl]amino]benzoic acid Traditional Name: 2,4-dichloro-6-[[2-(o-tolylthio)acetyl]amino]benzoic acid Formula: C16H13Cl2NO3S MolecularWeight: 370.25032

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1SCC(=O)NC2=CC(=CC(=C2C(=O)O)Cl)Cl

Isomeric SMILES

CC1=CC=CC=C1SCC(=O)NC2=CC(=CC(=C2C(=O)O)Cl)Cl

InChI

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