Vitas-M small molecule compound
2-[(5-ethyl-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl)sulfanyl]-1-phenylethanone
Catalog ID
STK843028
SMILES CCc1nc2sc3c(c2c2n1c(SCC(=O)c1ccccc1)nn2)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 C21H20N4OS2 MW 408.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N4OS2/c1-2-17-22-20-18(14-10-6-7-11-16(14)28-20)19-23-24-21(25(17)19)27-12-15(26)13-8-4-3-5-9-13/h3-5,8-9H,2,6-7,10-12H2,1H3InChIKey
WFGYLLNMYNSPQI-UHFFFAOYSA-NSynonyms
488122-81-22((5ethyl891011tetrahydro(1)benzothieno(32e)(124)triazolo(43c)pyrimidin3yl)sulfanyl)1phenylethanone
2((5ethyl891011tetrahydrobenzo(45)thieno(32e)(124)triazolo(43c)pyrimidin3yl)thio)1phenylethanone
488122812
CCC1=NC2=C(C3=C(S2)CCCC3)C4=NN=C(N14)SCC(=O)C5=CC=CC=C5
InChI=1SC21H20N4OS2c1217222018(1410671116(14)2820)19232421(25(17)19)271215(26)138435913h3589H2671012H21H3
MFCD03289556
ZINC000000794121
ZINC00794121
ZINC794121
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