Vitas-M small molecule compound
1-(morpholin-4-yl)-2-{[5-(propan-2-ylsulfanyl)-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl]sulfanyl}ethanone
Catalog ID
STK937842
SMILES CC(Sc1nc2sc3c(c2c2n1c(SCC(=O)N1CCOCC1)nn2)CCCC3)C
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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 C20H25N5O2S3 MW 463.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H25N5O2S3/c1-12(2)29-19-21-18-16(13-5-3-4-6-14(13)30-18)17-22-23-20(25(17)19)28-11-15(26)24-7-9-27-10-8-24/h12H,3-11H2,1-2H3InChIKey
VRRWGQICJBNAHN-UHFFFAOYSA-NSynonyms
850739-03-61(morpholin4yl)2((5(propan2ylsulfanyl)891011tetrahydro(1)benzothieno(32e)(124)triazolo(43c)pyrimidin3yl)sulfanyl)ethanone
2((5(isopropylthio)891011tetrahydrobenzo(45)thieno(32e)(124)triazolo(43c)pyrimidin3yl)thio)1morpholinoethanone
850739036
CC(C)SC1=NC2=C(C3=C(S2)CCCC3)C4=NN=C(N41)SCC(=O)N5CCOCC5
InChI=1SC20H25N5O2S3c112(2)2919211816(13534614(13)3018)17222320(25(17)19)281115(26)24792710824h12H311H212H3
MFCD05693580
ZINC000002404792
ZINC02404792
ZINC2404792
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