Vitas-M small molecule compound
1-[2-(4-chlorophenyl)-2-oxoethyl]-7-methyl-3-(methylsulfanyl)thieno[2,3-d][1,2,4]triazolo[4,3-a]pyrimidin-5(1H)-one
Catalog ID
STK928670
SMILES CSc1nn(c2n1c(=O)c1c(n2)sc(c1)C)CC(=O)c1ccc(cc1)Cl
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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 C17H13ClN4O2S2 MW 404.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H13ClN4O2S2/c1-9-7-12-14(26-9)19-16-21(20-17(25-2)22(16)15(12)24)8-13(23)10-3-5-11(18)6-4-10/h3-7H,8H2,1-2H3InChIKey
VUOPAVPRDRUPJD-UHFFFAOYSA-NSynonyms
1219540-88-11(2(4chlorophenyl)2oxoethyl)7methyl3(methylsulfanyl)thieno(23d)(124)triazolo(43a)pyrimidin5(1H)one
1(2(4chlorophenyl)2oxoethyl)7methyl3(methylthio)thieno(23d)(124)triazolo(43a)pyrimidin5(1H)one
1219540881
CC1=CC2=C(S1)N=C3N(N=C(N3C2=O)SC)CC(=O)C4=CC=C(C=C4)Cl
InChI=1SC17H13ClN4O2S2c1971214(269)191621(2017(252)22(16)15(12)24)813(23)103511(18)6410h37H8H212H3
MFCD16624291
ZINC000040267944
ZINC40267944
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