Vitas-M small molecule compound
2-[(3,4-dichlorobenzyl)sulfanyl]-6-ethyl-6-methyl-3-(prop-2-en-1-yl)-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Catalog ID
STK831200
SMILES C=CCn1c(SCc2ccc(c(c2)Cl)Cl)nc2c(c1=O)c1CC(C)(CC)OCc1s2
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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 C22H22Cl2N2O2S2 MW 481.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22Cl2N2O2S2/c1-4-8-26-20(27)18-14-10-22(3,5-2)28-11-17(14)30-19(18)25-21(26)29-12-13-6-7-15(23)16(24)9-13/h4,6-7,9H,1,5,8,10-12H2,2-3H3InChIKey
CXPBFTUUPMRBOQ-UHFFFAOYSA-NSynonyms
316359-97-42((34dichlorobenzyl)sulfanyl)6ethyl6methyl3(prop2en1yl)3568tetrahydro4Hpyrano(4345)thieno(23d)pyrimidin4one
2((34dichlorophenyl)methylsulfanyl)6ethyl6methyl3prop2enyl58dihydropyrano(23)thieno(24b)pyrimidin4one
316359974
3allyl2((34dichlorobenzyl)thio)6ethyl6methyl56dihydro3Hpyrano(4345)thieno(23d)pyrimidin4(8H)one
CCC1(CC2=C(CO1)SC3=C2C(=O)N(C(=N3)SCC4=CC(=C(C=C4)Cl)Cl)CC=C)C
InChI=1SC22H22Cl2N2O2S2c1482620(27)18141022(352)281117(14)3019(18)2521(26)2912136715(23)16(24)913h4679H1581012H223H3
MFCD01557447
ZINC000002362069
ZINC000002362071
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