3-[(2,4-dichlorophenyl)methyl]-2-methylsulfanyl-1H-indole-5-carboxylic acid

Systemtic Name: 3-[(2,4-dichlorophenyl)methyl]-2-methylsulfanyl-1H-indole-5-carboxylic acid Openeye Name: 3-[(2,4-dichlorophenyl)methyl]-2-methylsulfanyl-1H-indole-5-carboxylic acid CAS Name: 3-[(2,4-dichlorophenyl)methyl]-2-(methylthio)-1H-indole-5-carboxylic acid IUPAC Name: 3-[(2,4-dichlorophenyl)methyl]-2-methylsulfanyl-1H-indole-5-carboxylic acid Traditional Name: 3-(2,4-dichlorobenzyl)-2-(methylthio)-1H-indole-5-carboxylic acid Formula: C17H13Cl2NO2S MolecularWeight: 366.26162

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C2=C(N1)C=CC(=C2)C(=O)O)CC3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

CSC1=C(C2=C(N1)C=CC(=C2)C(=O)O)CC3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C17H13Cl2NO2S/c1-23-16-13(6-9-2-4-11(18)8-14(9)19)12-7-10(17(21)22)3-5-15(12)20-16/h2-5,7-8,20H,6H2,1H3,(H,21,22)