Vitas-M small molecule compound

6-(butylsulfanyl)-3,3-dimethyl-8-(morpholin-4-yl)-3,4-dihydro-1H-thiopyrano[3,4-c]pyridine-5-carbonitrile

Catalog ID
STK525486
SMILES CCCCSc1nc(N2CCOCC2)c2c(c1C#N)CC(SC2)(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 C19H27N3OS2 MW 377.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H27N3OS2/c1-4-5-10-24-18-15(12-20)14-11-19(2,3)25-13-16(14)17(21-18)22-6-8-23-9-7-22/h4-11,13H2,1-3H3
InChIKey
MXUHOMGAHMOVDW-UHFFFAOYSA-N
Synonyms
316360-22-2
316360222
6(butylsulfanyl)33dimethyl8(morpholin4yl)34dihydro1Hthiopyrano(34c)pyridine5carbonitrile
6(butylthio)33dimethyl8morpholino34dihydro1Hthiopyrano(34c)pyridine5carbonitrile
6BUTYLSULFANYL33DIMETHYL8MORPHOLIN4YL14DIHYDROTHIOPYRANO(34C)PYRIDINE5CARBONITRILE
CCCCSC1=NC(=C2CSC(CC2=C1C#N)(C)C)N3CCOCC3
InChI=1SC19H27N3OS2c14510241815(1220)141119(23)251316(14)17(2118)2268239722h41113H213H3
MFCD01557457
ZINC000013739354
ZINC13739354

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Available files

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