methyl 5-[[4-(2-prop-2-enylsulfanylpyridin-3-yl)carbonylmorpholin-2-yl]methoxy]pyridine-3-carboxylate

Systemtic Name: methyl 5-[[4-(2-prop-2-enylsulfanylpyridin-3-yl)carbonylmorpholin-2-yl]methoxy]pyridine-3-carboxylate Openeye Name: methyl 5-[[4-(2-allylsulfanylpyridine-3-carbonyl)morpholin-2-yl]methoxy]pyridine-3-carboxylate CAS Name: 5-[[4-[oxo-[2-(prop-2-enylthio)-3-pyridinyl]methyl]-2-morpholinyl]methoxy]-3-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 5-[[4-(2-prop-2-enylsulfanylpyridine-3-carbonyl)morpholin-2-yl]methoxy]pyridine-3-carboxylate Traditional Name: 5-[[4-[2-(allylthio)nicotinoyl]morpholin-2-yl]methoxy]nicotinic acid methyl ester Formula: C21H23N3O5S MolecularWeight: 429.48942

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CN=C1)OCC2CN(CCO2)C(=O)C3=C(N=CC=C3)SCC=C

Isomeric SMILES

COC(=O)C1=CC(=CN=C1)OCC2CN(CCO2)C(=O)C3=C(N=CC=C3)SCC=C

InChI

InChI=1S/C21H23N3O5S/c1-3-9-30-19-18(5-4-6-23-19)20(25)24-7-8-28-17(13-24)14-29-16-10-15(11-22-12-16)21(26)27-2/h3-6,10-12,17H,1,7-9,13-14H2,2H3