methyl 5-methoxy-3-methylsulfanyl-1H-indole-2-carboxylate

Systemtic Name: methyl 5-methoxy-3-methylsulfanyl-1H-indole-2-carboxylate Openeye Name: methyl 5-methoxy-3-methylsulfanyl-1H-indole-2-carboxylate CAS Name: 5-methoxy-3-(methylthio)-1H-indole-2-carboxylic acid methyl ester IUPAC Name: methyl 5-methoxy-3-methylsulfanyl-1H-indole-2-carboxylate Traditional Name: 5-methoxy-3-(methylthio)-1H-indole-2-carboxylic acid methyl ester Formula: C12H13NO3S MolecularWeight: 251.30152

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)NC(=C2SC)C(=O)OC

Isomeric SMILES

COC1=CC2=C(C=C1)NC(=C2SC)C(=O)OC

InChI

InChI=1S/C12H13NO3S/c1-15-7-4-5-9-8(6-7)11(17-3)10(13-9)12(14)16-2/h4-6,13H,1-3H3