Vitas-M small molecule compound
1-(4-fluorophenyl)-2-{[5-(methylsulfanyl)-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl]sulfanyl}ethanone
Catalog ID
STK720416
SMILES CSc1nc2sc3c(c2c2n1c(SCC(=O)c1ccc(cc1)F)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 C20H17FN4OS3 MW 444.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17FN4OS3/c1-27-19-22-18-16(13-4-2-3-5-15(13)29-18)17-23-24-20(25(17)19)28-10-14(26)11-6-8-12(21)9-7-11/h6-9H,2-5,10H2,1H3InChIKey
VNAHXMGFQLDECD-UHFFFAOYSA-NSynonyms
799806-65-81(4fluorophenyl)2((5(methylsulfanyl)891011tetrahydro(1)benzothieno(32e)(124)triazolo(43c)pyrimidin3yl)sulfanyl)ethanone
1(4fluorophenyl)2((5(methylthio)891011tetrahydrobenzo(45)thieno(32e)(124)triazolo(43c)pyrimidin3yl)thio)ethanone
799806658
CSC1=NC2=C(C3=C(S2)CCCC3)C4=NN=C(N41)SCC(=O)C5=CC=C(C=C5)F
InChI=1SC20H17FN4OS3c12719221816(13423515(13)2918)17232420(25(17)19)281014(26)116812(21)9711h69H2510H21H3
MFCD03679233
ZINC000002225616
ZINC02225616
ZINC2225616
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