Vitas-M small molecule compound
2-[(2-chlorobenzyl)sulfanyl]-3-(4-methoxyphenyl)-6,6-dimethyl-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Catalog ID
STK844021
SMILES COc1ccc(cc1)n1c(SCc2ccccc2Cl)nc2c(c1=O)c1CC(C)(C)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 C25H23ClN2O3S2 MW 499.05 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23ClN2O3S2/c1-25(2)12-18-20(13-31-25)33-22-21(18)23(29)28(16-8-10-17(30-3)11-9-16)24(27-22)32-14-15-6-4-5-7-19(15)26/h4-11H,12-14H2,1-3H3InChIKey
YJILVYWQDYATPI-UHFFFAOYSA-NSynonyms
713113-05-42((2chlorobenzyl)sulfanyl)3(4methoxyphenyl)66dimethyl3568tetrahydro4Hpyrano(4345)thieno(23d)pyrimidin4one
2((2chlorobenzyl)thio)3(4methoxyphenyl)66dimethyl56dihydro3Hpyrano(4345)thieno(23d)pyrimidin4(8H)one
2((2chlorophenyl)methylsulfanyl)3(4methoxyphenyl)66dimethyl58dihydropyrano(23)thieno(24b)pyrimidin4one
713113054
CC1(CC2=C(CO1)SC3=C2C(=O)N(C(=N3)SCC4=CC=CC=C4Cl)C5=CC=C(C=C5)OC)C
InChI=1SC25H23ClN2O3S2c125(2)121820(133125)332221(18)23(29)28(1681017(303)11916)24(2722)321415645719(15)26h411H1214H213H3
MFCD03681783
ZINC000002234982
ZINC02234982
ZINC2234982
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