Vitas-M small molecule compound
ethyl 3-{[(1-ethyl-4-oxo[1,2,4]triazolo[4,3-a]quinoxalin-5(4H)-yl)acetyl]amino}benzoate
Catalog ID
STL084673
SMILES CCOC(=O)c1cccc(c1)NC(=O)Cn1c(=O)c2nnc(n2c2c1cccc2)CC
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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 C22H21N5O4 MW 419.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21N5O4/c1-3-18-24-25-20-21(29)26(16-10-5-6-11-17(16)27(18)20)13-19(28)23-15-9-7-8-14(12-15)22(30)31-4-2/h5-12H,3-4,13H2,1-2H3,(H,23,28)InChIKey
MCBJYNZWMQSZRQ-UHFFFAOYSA-NSynonyms
CCC1=NN=C2N1C3=CC=CC=C3N(C2=O)CC(=O)NC4=CC=CC(=C4)C(=O)OCC
ethyl3(((1ethyl4oxo(124)triazolo(43a)quinoxalin5(4H)yl)acetyl)amino)benzoate
ethyl3((2(1ethyl4oxo(124)triazolo(43a)quinoxalin5yl)acetyl)amino)benzoate
InChI=1SC22H21N5O4c131824252021(29)26(1610561117(16)27(18)20)1319(28)231597814(1215)22(30)3142h512H3413H212H3(H2328)
MFCD18203229
ZINC000057522847
ZINC57522847
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