Vitas-M small molecule compound

2-[(5-phenyl-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl)sulfanyl]-1-(piperidin-1-yl)ethanone

Catalog ID
STK547843
SMILES O=C(N1CCCCC1)CSc1nnc2n1c(nc1c2c2CCCCc2s1)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 C24H25N5OS2 MW 463.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H25N5OS2/c30-19(28-13-7-2-8-14-28)15-31-24-27-26-22-20-17-11-5-6-12-18(17)32-23(20)25-21(29(22)24)16-9-3-1-4-10-16/h1,3-4,9-10H,2,5-8,11-15H2
InChIKey
GFGQPQOZHUCAIF-UHFFFAOYSA-N
Synonyms
489400-13-7
2((5phenyl891011tetrahydro(1)benzothieno(32e)(124)triazolo(43c)pyrimidin3yl)sulfanyl)1(piperidin1yl)ethanone
2((5phenyl891011tetrahydrobenzo(45)thieno(32e)(124)triazolo(43c)pyrimidin3yl)thio)1(piperidin1yl)ethanone
489400137
C1CCN(CC1)C(=O)CSC2=NN=C3N2C(=NC4=C3C5=C(S4)CCCC5)C6=CC=CC=C6
InChI=1SC24H25N5OS2c3019(28137281428)153124272622201711561218(17)3223(20)2521(29(22)24)1693141016h134910H2581115H2
MFCD03295829
ZINC000002248456
ZINC02248456
ZINC2248456

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Available files

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