methyl 3-(1H-indol-3-yl)-2-(2-pyridin-4-ylsulfanylethanoylamino)propanoate

Systemtic Name: methyl 3-(1H-indol-3-yl)-2-(2-pyridin-4-ylsulfanylethanoylamino)propanoate Openeye Name: methyl 3-(1H-indol-3-yl)-2-[[2-(4-pyridylsulfanyl)acetyl]amino]propanoate CAS Name: 3-(1H-indol-3-yl)-2-[[1-oxo-2-(pyridin-4-ylthio)ethyl]amino]propanoic acid methyl ester IUPAC Name: methyl 3-(1H-indol-3-yl)-2-[(2-pyridin-4-ylsulfanylacetyl)amino]propanoate Traditional Name: 3-(1H-indol-3-yl)-2-[[2-(4-pyridylthio)acetyl]amino]propionic acid methyl ester Formula: C19H19N3O3S MolecularWeight: 369.43746

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CNC2=CC=CC=C21)NC(=O)CSC3=CC=NC=C3

Isomeric SMILES

COC(=O)C(CC1=CNC2=CC=CC=C21)NC(=O)CSC3=CC=NC=C3

InChI

InChI=1S/C19H19N3O3S/c1-25-19(24)17(10-13-11-21-16-5-3-2-4-15(13)16)22-18(23)12-26-14-6-8-20-9-7-14/h2-9,11,17,21H,10,12H2,1H3,(H,22,23)