Vitas-M small molecule compound
6-(4-bromobenzyl)-2-(furan-2-yl)-6,8,9,10-tetrahydro-5H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-5-one
Catalog ID
STK644310
SMILES Brc1ccc(cc1)Cn1c2sc3c(c2c2n(c1=O)nc(n2)c1ccco1)CCC3
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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 C21H15BrN4O2S MW 467.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H15BrN4O2S/c22-13-8-6-12(7-9-13)11-25-20-17(14-3-1-5-16(14)29-20)19-23-18(15-4-2-10-28-15)24-26(19)21(25)27/h2,4,6-10H,1,3,5,11H2InChIKey
FLBLYNIJXKPJHG-UHFFFAOYSA-NSynonyms
951973-02-76(4bromobenzyl)2(furan2yl)68910tetrahydro5Hcyclopenta(45)thieno(32e)(124)triazolo(15c)pyrimidin5one
951973027
C1CC2=C(C1)SC3=C2C4=NC(=NN4C(=O)N3CC5=CC=C(C=C5)Br)C6=CC=CO6
InChI=1SC21H15BrN4O2Sc22138612(7913)11252017(1431516(14)2920)192318(1542102815)2426(19)21(25)27h24610H13511H2
MFCD09857608
ZINC000013730877
ZINC13730877
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