Vitas-M small molecule compound
2-[(3,4-dichlorobenzyl)sulfanyl]-3-(2-methoxyphenyl)-6,6-dimethyl-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Catalog ID
STK532025
SMILES COc1ccccc1n1c(SCc2ccc(c(c2)Cl)Cl)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 C25H22Cl2N2O3S2 MW 533.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22Cl2N2O3S2/c1-25(2)11-15-20(12-32-25)34-22-21(15)23(30)29(18-6-4-5-7-19(18)31-3)24(28-22)33-13-14-8-9-16(26)17(27)10-14/h4-10H,11-13H2,1-3H3InChIKey
KOUJRESJHVCWCF-UHFFFAOYSA-NSynonyms
2((34dichlorobenzyl)sulfanyl)3(2methoxyphenyl)66dimethyl3568tetrahydro4Hpyrano(4345)thieno(23d)pyrimidin4one
2((34dichlorobenzyl)thio)3(2methoxyphenyl)66dimethyl56dihydro3Hpyrano(4345)thieno(23d)pyrimidin4(8H)one
2((34dichlorophenyl)methylsulfanyl)3(2methoxyphenyl)66dimethyl58dihydropyrano(23)thieno(24b)pyrimidin4one
CC1(CC2=C(CO1)SC3=C2C(=O)N(C(=N3)SCC4=CC(=C(C=C4)Cl)Cl)C5=CC=CC=C5OC)C
InChI=1SC25H22Cl2N2O3S2c125(2)111520(123225)342221(15)23(30)29(18645719(18)313)24(2822)3313148916(26)17(27)1014h410H1113H213H3
MFCD02234008
ZINC000002292275
ZINC2292275
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