Vitas-M small molecule compound
2-{5-[3-(5-bromopyridin-3-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]pentyl}-1H-isoindole-1,3(2H)-dione
Catalog ID
STK645044
SMILES Brc1cncc(c1)c1nnc2n1nc(s2)CCCCCN1C(=O)c2c(C1=O)cccc2
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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 C21H17BrN6O2S MW 497.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17BrN6O2S/c22-14-10-13(11-23-12-14)18-24-25-21-28(18)26-17(31-21)8-2-1-5-9-27-19(29)15-6-3-4-7-16(15)20(27)30/h3-4,6-7,10-12H,1-2,5,8-9H2InChIKey
RMOKSAUXQDDWEH-UHFFFAOYSA-NSynonyms
951987-62-52(5(3(5bromopyridin3yl)(124)triazolo(34b)(134)thiadiazol6yl)pentyl)1Hisoindole13(2H)dione
2(5(3(5bromopyridin3yl)(124)triazolo(34b)(134)thiadiazol6yl)pentyl)isoindole13dione
2(5(3(5bromopyridin3yl)(124)triazolo(34b)(134)thiadiazol6yl)pentyl)isoindoline13dione
951987625
C1=CC=C2C(=C1)C(=O)N(C2=O)CCCCCC3=NN4C(=NN=C4S3)C5=CC(=CN=C5)Br
InChI=1SC21H17BrN6O2Sc22141013(11231214)1824252128(18)2617(3121)821592719(29)15634716(15)20(27)30h34671012H12589H2
MFCD09851700
ZINC000013690355
ZINC13690355
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