ethyl 2-(1-morpholin-4-yl-1-oxidanylidene-butan-2-yl)sulfanylpyridine-3-carboxylate

Systemtic Name: ethyl 2-(1-morpholin-4-yl-1-oxidanylidene-butan-2-yl)sulfanylpyridine-3-carboxylate Openeye Name: ethyl 2-[1-(morpholine-4-carbonyl)propylsulfanyl]pyridine-3-carboxylate CAS Name: 2-[[1-(4-morpholinyl)-1-oxobutan-2-yl]thio]-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-(1-morpholin-4-yl-1-oxobutan-2-yl)sulfanylpyridine-3-carboxylate Traditional Name: 2-[1-(morpholine-4-carbonyl)propylthio]nicotinic acid ethyl ester Formula: C16H22N2O4S MolecularWeight: 338.42188

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)N1CCOCC1)SC2=C(C=CC=N2)C(=O)OCC

Isomeric SMILES

CCC(C(=O)N1CCOCC1)SC2=C(C=CC=N2)C(=O)OCC

InChI

InChI=1S/C16H22N2O4S/c1-3-13(15(19)18-8-10-21-11-9-18)23-14-12(6-5-7-17-14)16(20)22-4-2/h5-7,13H,3-4,8-11H2,1-2H3