Vitas-M small molecule compound

3-cyclohexyl-6,6-dimethyl-2-[(2-methylprop-2-en-1-yl)sulfanyl]-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one

Catalog ID
STK058779
SMILES CC(=C)CSc1nc2sc3c(c2c(=O)n1C1CCCCC1)CC(OC3)(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 C21H28N2O2S2 MW 404.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H28N2O2S2/c1-13(2)12-26-20-22-18-17(15-10-21(3,4)25-11-16(15)27-18)19(24)23(20)14-8-6-5-7-9-14/h14H,1,5-12H2,2-4H3
InChIKey
VYXCNOISZNPLMP-UHFFFAOYSA-N
Synonyms
351006-91-2
351006912
3cyclohexyl66dimethyl2((2methylallyl)thio)56dihydro3Hpyrano(4345)thieno(23d)pyrimidin4(8H)one
3cyclohexyl66dimethyl2((2methylprop2en1yl)sulfanyl)3568tetrahydro4Hpyrano(4345)thieno(23d)pyrimidin4one
3cyclohexyl66dimethyl2(2methylprop2enylsulfanyl)58dihydropyrano(23)thieno(24b)pyrimidin4one
CC(=C)CSC1=NC2=C(C3=C(S2)COC(C3)(C)C)C(=O)N1C4CCCCC4
CC(=C)CSc1nc2sc3c(c2c(=O)n1C1CCCCC1)CC(OC3)(C)C
InChI=1SC21H28N2O2S2c113(2)122620221817(151021(34)251116(15)2718)19(24)23(20)148657914h14H1512H224H3
MFCD01559578
STK058779
ZINC000000752726
ZINC00752726
ZINC752726

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Available files

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