ethyl 3-[(5-cyano-3,3-dimethyl-8-morpholin-4-yl-1,4-dihydropyrano[3,4-c]pyridin-6-yl)sulfanyl]propanoate

Systemtic Name: ethyl 3-[(5-cyano-3,3-dimethyl-8-morpholin-4-yl-1,4-dihydropyrano[3,4-c]pyridin-6-yl)sulfanyl]propanoate Openeye Name: ethyl 3-[(5-cyano-3,3-dimethyl-8-morpholino-1,4-dihydropyrano[3,4-c]pyridin-6-yl)sulfanyl]propanoate CAS Name: 3-[[5-cyano-3,3-dimethyl-8-(4-morpholinyl)-1,4-dihydropyrano[3,4-c]pyridin-6-yl]thio]propanoic acid ethyl ester IUPAC Name: ethyl 3-[(5-cyano-3,3-dimethyl-8-morpholin-4-yl-1,4-dihydropyrano[3,4-c]pyridin-6-yl)sulfanyl]propanoate Traditional Name: 3-[(5-cyano-3,3-dimethyl-8-morpholino-1,4-dihydropyrano[3,4-c]pyridin-6-yl)thio]propionic acid ethyl ester Formula: C20H27N3O4S MolecularWeight: 405.51108

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCSC1=NC(=C2COC(CC2=C1C#N)(C)C)N3CCOCC3

Isomeric SMILES

CCOC(=O)CCSC1=NC(=C2COC(CC2=C1C#N)(C)C)N3CCOCC3

InChI

InChI=1S/C20H27N3O4S/c1-4-26-17(24)5-10-28-19-15(12-21)14-11-20(2,3)27-13-16(14)18(22-19)23-6-8-25-9-7-23/h4-11,13H2,1-3H3