3-(3-methyl-2-methylsulfanyl-imidazol-4-yl)-1H-indole-2-carboxylic acid

Systemtic Name: 3-(3-methyl-2-methylsulfanyl-imidazol-4-yl)-1H-indole-2-carboxylic acid Openeye Name: 3-(3-methyl-2-methylsulfanyl-imidazol-4-yl)-1H-indole-2-carboxylic acid CAS Name: 3-[3-methyl-2-(methylthio)-4-imidazolyl]-1H-indole-2-carboxylic acid IUPAC Name: 3-(3-methyl-2-methylsulfanylimidazol-4-yl)-1H-indole-2-carboxylic acid Traditional Name: 3-[3-methyl-2-(methylthio)imidazol-4-yl]-1H-indole-2-carboxylic acid Formula: C14H13N3O2S MolecularWeight: 287.33692

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CN=C1SC)C2=C(NC3=CC=CC=C32)C(=O)O

Isomeric SMILES

CN1C(=CN=C1SC)C2=C(NC3=CC=CC=C32)C(=O)O

InChI

InChI=1S/C14H13N3O2S/c1-17-10(7-15-14(17)20-2)11-8-5-3-4-6-9(8)16-12(11)13(18)19/h3-7,16H,1-2H3,(H,18,19)