Vitas-M small molecule compound
3-[(1,3-benzodioxol-5-ylmethyl)sulfanyl]-9,10-dihydro-8H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidine
Catalog ID
STL333455
SMILES C1Cc2c(C1)c1c(s2)ncn2c1nnc2SCc1ccc2c(c1)OCO2
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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 C18H14N4O2S2 MW 382.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H14N4O2S2/c1-2-11-14(3-1)26-17-15(11)16-20-21-18(22(16)8-19-17)25-7-10-4-5-12-13(6-10)24-9-23-12/h4-6,8H,1-3,7,9H2InChIKey
MJDXZRBKBWOKIG-UHFFFAOYSA-NSynonyms
488101-16-23((13benzodioxol5ylmethyl)sulfanyl)910dihydro8Hcyclopenta(45)thieno(32e)(124)triazolo(43c)pyrimidine
3((benzo(d)(13)dioxol5ylmethyl)thio)910dihydro8Hcyclopenta(45)thieno(32e)(124)triazolo(43c)pyrimidine
488101162
C1CC2=C(C1)SC3=C2C4=NN=C(N4C=N3)SCC5=CC6=C(C=C5)OCO6
InChI=1SC18H14N4O2S2c121114(31)261715(11)16202118(22(16)81917)25710451213(610)2492312h468H1379H2
MFCD03288551
ZINC000001249509
ZINC01249509
ZINC1249509
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