methyl 3-[2-(1H-indol-3-yl)-2-oxidanylidene-ethyl]sulfanylpropanoate

Systemtic Name: methyl 3-[2-(1H-indol-3-yl)-2-oxidanylidene-ethyl]sulfanylpropanoate Openeye Name: methyl 3-[2-(1H-indol-3-yl)-2-oxo-ethyl]sulfanylpropanoate CAS Name: 3-[[2-(1H-indol-3-yl)-2-oxoethyl]thio]propanoic acid methyl ester IUPAC Name: methyl 3-[2-(1H-indol-3-yl)-2-oxoethyl]sulfanylpropanoate Traditional Name: 3-[[2-(1H-indol-3-yl)-2-keto-ethyl]thio]propionic acid methyl ester Formula: C14H15NO3S MolecularWeight: 277.3388

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCSCC(=O)C1=CNC2=CC=CC=C21

Isomeric SMILES

COC(=O)CCSCC(=O)C1=CNC2=CC=CC=C21

InChI

InChI=1S/C14H15NO3S/c1-18-14(17)6-7-19-9-13(16)11-8-15-12-5-3-2-4-10(11)12/h2-5,8,15H,6-7,9H2,1H3