Vitas-M small molecule compound
3,7-bis[(1,3-benzodioxol-5-ylmethyl)sulfanyl]-11-tert-butyl-10,11,12,13-tetrahydro[1]benzothieno[3,2-e]bis[1,2,4]triazolo[4,3-a:4',3'-c]pyrimidine
Catalog ID
STK541778
SMILES CC(C1CCc2c(C1)sc1c2c2nnc(n2c2n1c(SCc1ccc3c(c1)OCO3)nn2)SCc1ccc2c(c1)OCO2)(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 C32H30N6O4S3 MW 658.83 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H30N6O4S3/c1-32(2,3)19-6-7-20-25(12-19)45-28-26(20)27-33-35-30(43-13-17-4-8-21-23(10-17)41-15-39-21)37(27)29-34-36-31(38(28)29)44-14-18-5-9-22-24(11-18)42-16-40-22/h4-5,8-11,19H,6-7,12-16H2,1-3H3InChIKey
BFLYUMFMGMKBTK-UHFFFAOYSA-NSynonyms
37bis((13benzodioxol5ylmethyl)sulfanyl)11tertbutyl10111213tetrahydro(1)benzothieno(32e)bis(124)triazolo(43a43c)pyrimidine
37bis((benzo(d)(13)dioxol5ylmethyl)thio)11(tertbutyl)10111213tetrahydrobenzo(45)thieno(32e)bis((124)triazolo)(43a43c)pyrimidine
CC(C)(C)C1CCC2=C(C1)SC3=C2C4=NN=C(N4C5=NN=C(N35)SCC6=CC7=C(C=C6)OCO7)SCC8=CC9=C(C=C8)OCO9
InChI=1SC32H30N6O4S3c132(23)19672025(1219)452826(20)27333530(431317482123(1017)41153921)37(27)29343631(38(28)29)441418592224(1118)42164022h4581119H671216H213H3
MFCD03291952
ZINC000150424994
ZINC000150424997
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