Vitas-M small molecule compound
4-ethyl-1-[(4-methoxybenzyl)sulfanyl]-6,7,8,9-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Catalog ID
STK829820
SMILES COc1ccc(cc1)CSc1nnc2n1c1sc3c(c1c(=O)n2CC)CCCC3
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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 C21H22N4O2S2 MW 426.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N4O2S2/c1-3-24-18(26)17-15-6-4-5-7-16(15)29-19(17)25-20(24)22-23-21(25)28-12-13-8-10-14(27-2)11-9-13/h8-11H,3-7,12H2,1-2H3InChIKey
IEAQVGDYXQASAZ-UHFFFAOYSA-NSynonyms
498569-16-7498569167
4ethyl1((4methoxybenzyl)sulfanyl)6789tetrahydro(1)benzothieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
4ethyl1((4methoxybenzyl)thio)6789tetrahydrobenzo(45)thieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
CCN1C(=O)C2=C(N3C1=NN=C3SCC4=CC=C(C=C4)OC)SC5=C2CCCC5
InChI=1SC21H22N4O2S2c132418(26)1715645716(15)2919(17)2520(24)222321(25)28121381014(272)11913h811H3712H212H3
MFCD03302022
ZINC000001258987
ZINC01258987
ZINC1258987
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