3-(4-fluorophenyl)sulfanyl-6-methylsulfonyl-1H-indole-2-carboxylic acid

Systemtic Name: 3-(4-fluorophenyl)sulfanyl-6-methylsulfonyl-1H-indole-2-carboxylic acid Openeye Name: 3-(4-fluorophenyl)sulfanyl-6-methylsulfonyl-1H-indole-2-carboxylic acid CAS Name: 3-[(4-fluorophenyl)thio]-6-methylsulfonyl-1H-indole-2-carboxylic acid IUPAC Name: 3-(4-fluorophenyl)sulfanyl-6-methylsulfonyl-1H-indole-2-carboxylic acid Traditional Name: 3-[(4-fluorophenyl)thio]-6-mesyl-1H-indole-2-carboxylic acid Formula: C16H12FNO4S2 MolecularWeight: 365.399183

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC2=C(C=C1)C(=C(N2)C(=O)O)SC3=CC=C(C=C3)F

Isomeric SMILES

CS(=O)(=O)C1=CC2=C(C=C1)C(=C(N2)C(=O)O)SC3=CC=C(C=C3)F

InChI

InChI=1S/C16H12FNO4S2/c1-24(21,22)11-6-7-12-13(8-11)18-14(16(19)20)15(12)23-10-4-2-9(17)3-5-10/h2-8,18H,1H3,(H,19,20)