Vitas-M small molecule compound
3-[(2,6-dichlorobenzyl)sulfanyl]-10-ethyl-10-methyl-5-(methylsulfanyl)-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidine
Catalog ID
STK720367
SMILES CCC1(C)OCc2c(C1)c1c(s2)nc(n2c1nnc2SCc1c(Cl)cccc1Cl)SC
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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 C21H20Cl2N4OS3 MW 511.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20Cl2N4OS3/c1-4-21(2)8-11-15(9-28-21)31-18-16(11)17-25-26-20(27(17)19(24-18)29-3)30-10-12-13(22)6-5-7-14(12)23/h5-7H,4,8-10H2,1-3H3InChIKey
SWBYJBDTVRCLMC-UHFFFAOYSA-NSynonyms
799786-29-13((26dichlorobenzyl)sulfanyl)10ethyl10methyl5(methylsulfanyl)1011dihydro8Hpyrano(4345)thieno(32e)(124)triazolo(43c)pyrimidine
3((26dichlorobenzyl)thio)10ethyl10methyl5(methylthio)1011dihydro8Hpyrano(4345)thieno(32e)(124)triazolo(43c)pyrimidine
799786291
CCC1(CC2=C(CO1)SC3=C2C4=NN=C(N4C(=N3)SC)SCC5=C(C=CC=C5Cl)Cl)C
InChI=1SC21H20Cl2N4OS3c1421(2)81115(92821)311816(11)17252620(27(17)19(2418)293)30101213(22)65714(12)23h57H4810H213H3
MFCD03675527
ZINC000008738316
ZINC000013660974
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