Vitas-M small molecule compound
3-{[2-(1,3-benzodioxol-5-yl)-4-oxopyrazolo[1,5-a]pyrazin-5(4H)-yl]methyl}benzonitrile
Catalog ID
STL126268
SMILES N#Cc1cccc(c1)Cn1ccn2c(c1=O)cc(n2)c1ccc2c(c1)OCO2
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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 C21H14N4O3 MW 370.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H14N4O3/c22-11-14-2-1-3-15(8-14)12-24-6-7-25-18(21(24)26)10-17(23-25)16-4-5-19-20(9-16)28-13-27-19/h1-10H,12-13H2InChIKey
DBNGAXIJPAFGNY-UHFFFAOYSA-NSynonyms
1326833-05-91326833059
3((2(13benzodioxol5yl)4oxopyrazolo(15a)pyrazin5(4H)yl)methyl)benzonitrile
3((2(13benzodioxol5yl)4oxopyrazolo(15a)pyrazin5yl)methyl)benzonitrile
C1OC2=C(O1)C=C(C=C2)C3=NN4C=CN(C(=O)C4=C3)CC5=CC=CC(=C5)C#N
InChI=1SC21H14N4O3c22111421315(814)1224672518(21(24)26)1017(2325)16451920(916)28132719h110H1213H2
MFCD20738699
ZINC000067260780
ZINC67260780
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