Vitas-M small molecule compound
2-[9-(4-butoxyphenyl)-3-oxopyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-2(3H)-yl]-N-(2-chlorophenyl)acetamide
Catalog ID
STL128846
SMILES CCCCOc1ccc(cc1)c1nn2c(c1)c1nn(c(=O)n1cc2)CC(=O)Nc1ccccc1Cl
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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 C25H23ClN6O3 MW 490.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23ClN6O3/c1-2-3-14-35-18-10-8-17(9-11-18)21-15-22-24-29-32(25(34)30(24)12-13-31(22)28-21)16-23(33)27-20-7-5-4-6-19(20)26/h4-13,15H,2-3,14,16H2,1H3,(H,27,33)InChIKey
MXHFWEGVJCDCGH-UHFFFAOYSA-NSynonyms
2(9(4butoxyphenyl)3oxopyrazolo(15a)(124)triazolo(34c)pyrazin2(3H)yl)N(2chlorophenyl)acetamide
CCCCOC1=CC=C(C=C1)C2=NN3C=CN4C(=NN(C4=O)CC(=O)NC5=CC=CC=C5Cl)C3=C2
InChI=1SC25H23ClN6O3c12314351810817(91118)211522242932(25(34)30(24)121331(22)2821)1623(33)2720754619(20)26h41315H231416H21H3(H2733)
MFCD20742680
ZINC000067290628
ZINC67290628
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