Vitas-M small molecule compound
6,6-dimethyl-3-(4-methylphenyl)-2-(prop-2-en-1-ylsulfanyl)-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Catalog ID
STK042456
SMILES C=CCSc1nc2sc3c(c2c(=O)n1c1ccc(cc1)C)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 C21H22N2O2S2 MW 398.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N2O2S2/c1-5-10-26-20-22-18-17(15-11-21(3,4)25-12-16(15)27-18)19(24)23(20)14-8-6-13(2)7-9-14/h5-9H,1,10-12H2,2-4H3InChIKey
WXWKIYZHHPDTMK-UHFFFAOYSA-NSynonyms
351006-73-02(allylthio)66dimethyl3(ptolyl)56dihydro3Hpyrano(4345)thieno(23d)pyrimidin4(8H)one
351006730
66dimethyl3(4methylphenyl)2(prop2en1ylsulfanyl)3568tetrahydro4Hpyrano(4345)thieno(23d)pyrimidin4one
66dimethyl3(4methylphenyl)2prop2enylsulfanyl58dihydropyrano(23)thieno(24b)pyrimidin4one
C=CCSc1nc2sc3c(c2c(=O)n1c1ccc(cc1)C)CC(OC3)(C)C
CC1=CC=C(C=C1)N2C(=O)C3=C(N=C2SCC=C)SC4=C3CC(OC4)(C)C
InChI=1SC21H22N2O2S2c15102620221817(151121(34)251216(15)2718)19(24)23(20)148613(2)7914h59H11012H224H3
MFCD01565664
STK042456
ZINC000002266321
ZINC02266321
ZINC2266321
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