Vitas-M small molecule compound
3,7-bis[(1,3-benzodioxol-5-ylmethyl)sulfanyl]-12-(propan-2-yl)-12,13-dihydro-10H-pyrano[4',3':4,5]thieno[3,2-e]bis[1,2,4]triazolo[4,3-a:4',3'-c]pyrimidine
Catalog ID
STK926061
SMILES CC(C1OCc2c(C1)c1c3nnc(n3c3n(c1s2)c(SCc1ccc2c(c1)OCO2)nn3)SCc1ccc2c(c1)OCO2)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 C30H26N6O5S3 MW 646.77 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H26N6O5S3/c1-15(2)21-9-18-24(10-37-21)44-27-25(18)26-31-33-29(42-11-16-3-5-19-22(7-16)40-13-38-19)35(26)28-32-34-30(36(27)28)43-12-17-4-6-20-23(8-17)41-14-39-20/h3-8,15,21H,9-14H2,1-2H3InChIKey
NYPISHFWNHEWMJ-UHFFFAOYSA-NSynonyms
37bis((13benzodioxol5ylmethyl)sulfanyl)12(propan2yl)1213dihydro10Hpyrano(4345)thieno(32e)bis(124)triazolo(43a43c)pyrimidine
37bis((benzo(d)(13)dioxol5ylmethyl)thio)12isopropyl1213dihydro10Hpyrano(4345)thieno(32e)bis((124)triazolo)(43a43c)pyrimidine
CC(C)C1CC2=C(CO1)SC3=C2C4=NN=C(N4C5=NN=C(N35)SCC6=CC7=C(C=C6)OCO7)SCC8=CC9=C(C=C8)OCO9
InChI=1SC30H26N6O5S3c115(2)2191824(103721)442725(18)26313329(421116351922(716)40133819)35(26)28323430(36(27)28)431217462023(817)41143920h381521H914H212H3
MFCD03303313
ZINC000044459991
ZINC000150382564
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