methyl 2-(1-methylindol-3-yl)sulfanylethanoate

Systemtic Name: methyl 2-(1-methylindol-3-yl)sulfanylethanoate Openeye Name: methyl 2-(1-methylindol-3-yl)sulfanylacetate CAS Name: 2-[(1-methyl-3-indolyl)thio]acetic acid methyl ester IUPAC Name: methyl 2-(1-methylindol-3-yl)sulfanylacetate Traditional Name: 2-[(1-methylindol-3-yl)thio]acetic acid methyl ester Formula: C12H13NO2S MolecularWeight: 235.30212

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C2=CC=CC=C21)SCC(=O)OC

Isomeric SMILES

CN1C=C(C2=CC=CC=C21)SCC(=O)OC

InChI

InChI=1S/C12H13NO2S/c1-13-7-11(16-8-12(14)15-2)9-5-3-4-6-10(9)13/h3-7H,8H2,1-2H3