Vitas-M small molecule compound
3-cyclohexyl-6,6-dimethyl-2-thioxo-1,2,3,5,6,8-hexahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Catalog ID
STK011851
SMILES S=c1[nH]c2sc3c(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 C17H22N2O2S2 MW 350.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H22N2O2S2/c1-17(2)8-11-12(9-21-17)23-14-13(11)15(20)19(16(22)18-14)10-6-4-3-5-7-10/h10H,3-9H2,1-2H3,(H,18,22)InChIKey
KCKSTBQULJLGMF-UHFFFAOYSA-NSynonyms
312536-23-5312536235
3cyclohexyl66dimethyl2sulfanylidene58dihydro1Hpyrano(23)thieno(24b)pyrimidin4one
3cyclohexyl66dimethyl2thioxo123568hexahydro4Hpyrano(4345)thieno(23d)pyrimidin4one
3cyclohexyl66dimethyl2thioxo2356tetrahydro1Hpyrano(4345)thieno(23d)pyrimidin4(8H)one
CC1(CC2=C(CO1)SC3=C2C(=O)N(C(=S)N3)C4CCCCC4)C
InChI=1SC17H22N2O2S2c117(2)81112(92117)231413(11)15(20)19(16(22)1814)106435710h10H39H212H3(H1822)
MFCD01242524
S=c1(nH)c2sc3c(c2c(=O)n1C1CCCCC1)CC(OC3)(C)C
STK011851
ZINC18275848
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