Vitas-M small molecule compound
5-(azepan-1-yl)-3-[(4-bromophenyl)sulfonyl]thieno[2,3-e][1,2,3]triazolo[1,5-a]pyrimidine
Catalog ID
STL085965
SMILES Brc1ccc(cc1)S(=O)(=O)c1nnn2c1nc(N1CCCCCC1)c1c2ccs1
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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 C19H18BrN5O2S2 MW 492.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18BrN5O2S2/c20-13-5-7-14(8-6-13)29(26,27)19-18-21-17(24-10-3-1-2-4-11-24)16-15(9-12-28-16)25(18)23-22-19/h5-9,12H,1-4,10-11H2InChIKey
QKHPRPXFAVBIAP-UHFFFAOYSA-NSynonyms
892748-48-05(azepan1yl)3((4bromophenyl)sulfonyl)thieno(23e)(123)triazolo(15a)pyrimidine
892748480
C1CCCN(CC1)C2=NC3=C(N=NN3C4=C2SC=C4)S(=O)(=O)C5=CC=C(C=C5)Br
InChI=1SC19H18BrN5O2S2c20135714(8613)29(2627)19182117(241031241124)1615(9122816)25(18)232219h5912H141011H2
MFCD07654675
ZINC000009909500
ZINC09909500
ZINC9909500
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