Vitas-M small molecule compound
4-butyl-1-[(2-oxo-2-phenylethyl)sulfanyl]-6,7,8,9-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Catalog ID
STK526137
SMILES CCCCn1c2nnc(n2c2c(c1=O)c1CCCCc1s2)SCC(=O)c1ccccc1
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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 C23H24N4O2S2 MW 452.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H24N4O2S2/c1-2-3-13-26-20(29)19-16-11-7-8-12-18(16)31-21(19)27-22(26)24-25-23(27)30-14-17(28)15-9-5-4-6-10-15/h4-6,9-10H,2-3,7-8,11-14H2,1H3InChIKey
NXNBKCZEBZLPHL-UHFFFAOYSA-NSynonyms
374091-03-9374091039
4butyl1((2oxo2phenylethyl)sulfanyl)6789tetrahydro(1)benzothieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
4butyl1((2oxo2phenylethyl)thio)6789tetrahydrobenzo(45)thieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
CCCCN1C(=O)C2=C(N3C1=NN=C3SCC(=O)C4=CC=CC=C4)SC5=C2CCCC5
InChI=1SC23H24N4O2S2c123132620(29)191611781218(16)3121(19)2722(26)242523(27)301417(28)1595461015h46910H23781114H21H3
MFCD01950800
ZINC000002283001
ZINC02283001
ZINC2283001
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