ethyl 5-(4-ethylsulfanylphenyl)-4-methyl-4-morpholin-4-yl-5-oxidanylidene-pentanoate

Systemtic Name: ethyl 5-(4-ethylsulfanylphenyl)-4-methyl-4-morpholin-4-yl-5-oxidanylidene-pentanoate Openeye Name: ethyl 5-(4-ethylsulfanylphenyl)-4-methyl-4-morpholino-5-oxo-pentanoate CAS Name: 5-[4-(ethylthio)phenyl]-4-methyl-4-(4-morpholinyl)-5-oxopentanoic acid ethyl ester IUPAC Name: ethyl 5-(4-ethylsulfanylphenyl)-4-methyl-4-morpholin-4-yl-5-oxopentanoate Traditional Name: 5-[4-(ethylthio)phenyl]-5-keto-4-methyl-4-morpholino-valeric acid ethyl ester Formula: C20H29NO4S MolecularWeight: 379.51356

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC(C)(C(=O)C1=CC=C(C=C1)SCC)N2CCOCC2

Isomeric SMILES

CCOC(=O)CCC(C)(C(=O)C1=CC=C(C=C1)SCC)N2CCOCC2

InChI

InChI=1S/C20H29NO4S/c1-4-25-18(22)10-11-20(3,21-12-14-24-15-13-21)19(23)16-6-8-17(9-7-16)26-5-2/h6-9H,4-5,10-15H2,1-3H3