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

Systemtic Name: methyl 3-[2-[2-(1H-indol-3-yl)ethylamino]-2-oxidanylidene-ethyl]sulfanylpropanoate Openeye Name: methyl 3-[2-[2-(1H-indol-3-yl)ethylamino]-2-oxo-ethyl]sulfanylpropanoate CAS Name: 3-[[2-[2-(1H-indol-3-yl)ethylamino]-2-oxoethyl]thio]propanoic acid methyl ester IUPAC Name: methyl 3-[2-[2-(1H-indol-3-yl)ethylamino]-2-oxoethyl]sulfanylpropanoate Traditional Name: 3-[[2-[2-(1H-indol-3-yl)ethylamino]-2-keto-ethyl]thio]propionic acid methyl ester Formula: C16H20N2O3S MolecularWeight: 320.4066

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCSCC(=O)NCCC1=CNC2=CC=CC=C21

Isomeric SMILES

COC(=O)CCSCC(=O)NCCC1=CNC2=CC=CC=C21

InChI

InChI=1S/C16H20N2O3S/c1-21-16(20)7-9-22-11-15(19)17-8-6-12-10-18-14-5-3-2-4-13(12)14/h2-5,10,18H,6-9,11H2,1H3,(H,17,19)