Vitas-M small molecule compound

ethyl 2-{[5-cyano-3,3-dimethyl-8-(morpholin-4-yl)-3,4-dihydro-1H-pyrano[3,4-c]pyridin-6-yl]sulfanyl}propanoate

Catalog ID
STK526761
SMILES CCOC(=O)C(Sc1nc(N2CCOCC2)c2c(c1C#N)CC(OC2)(C)C)C

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C20H27N3O4S MW 405.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H27N3O4S/c1-5-26-19(24)13(2)28-18-15(11-21)14-10-20(3,4)27-12-16(14)17(22-18)23-6-8-25-9-7-23/h13H,5-10,12H2,1-4H3
InChIKey
SZBHORGVZOSENO-UHFFFAOYSA-N
Synonyms
330819-57-3
330819573
CCOC(=O)C(C)SC1=NC(=C2COC(CC2=C1C#N)(C)C)N3CCOCC3
ETHYL(2R)2((5CYANO33DIMETHYL8(MORPHOLIN4YL)34DIHYDRO1HPYRANO(34C)PYRIDIN6YL)SULFANYL)PROPANOATE
ETHYL2((5CYANO33DIMETHYL8(4MORPHOLINYL)34DIHYDRO1HPYRANO(34C)PYRIDIN6YL)SULFANYL)PROPANOATE
ethyl2((5cyano33dimethyl8(morpholin4yl)34dihydro1Hpyrano(34c)pyridin6yl)sulfanyl)propanoate
ETHYL2((5CYANO33DIMETHYL8MORPHOLIN4YL14DIHYDROPYRANO(34C)PYRIDIN6YL)SULFANYL)PROPANOATE
ethyl2((5cyano33dimethyl8morpholino34dihydro1Hpyrano(34c)pyridin6yl)thio)propanoate
ETHYL2(5CYANO33DIMETHYL8MORPHOLIN4YL34DIHYDRO1HPYRANO(43D)PYRIDIN6YLTHIO)PROPANOATE
InChI=1SC20H27N3O4Sc152619(24)13(2)281815(1121)141020(34)271216(14)17(2218)2368259723h13H51012H214H3
MFCD00296422
ZINC000019144425
ZINC000019144430

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.