Vitas-M small molecule compound
N-butyl-2-{8-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]-3-oxo[1,2,4]triazolo[4,3-a]pyridin-2(3H)-yl}-N-ethylacetamide
Catalog ID
STL078714
SMILES CCCCN(C(=O)Cn1nc2n(c1=O)cccc2c1onc(n1)c1ccc(cc1)Cl)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 C22H23ClN6O3 MW 454.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23ClN6O3/c1-3-5-12-27(4-2)18(30)14-29-22(31)28-13-6-7-17(20(28)25-29)21-24-19(26-32-21)15-8-10-16(23)11-9-15/h6-11,13H,3-5,12,14H2,1-2H3InChIKey
ACSMGMBLZVKXDK-UHFFFAOYSA-NSynonyms
CCCCN(CC)C(=O)CN1C(=O)N2C=CC=C(C2=N1)C3=NC(=NO3)C4=CC=C(C=C4)Cl
InChI=1SC22H23ClN6O3c1351227(42)18(30)142922(31)28136717(20(28)2529)212419(263221)1581016(23)11915h61113H351214H212H3
MFCD18199922
Nbutyl2(8(3(4chlorophenyl)124oxadiazol5yl)3oxo(124)triazolo(43a)pyridin2(3H)yl)Nethylacetamide
Nbutyl2(8(3(4chlorophenyl)124oxadiazol5yl)3oxo(124)triazolo(43a)pyridin2yl)Nethylacetamide
ZINC000057503297
ZINC57503297
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