Vitas-M small molecule compound

N-butyl-2-{8-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]-3-oxo[1,2,4]triazolo[4,3-a]pyridin-2(3H)-yl}acetamide

Catalog ID
STL078778
SMILES CCCCNC(=O)Cn1nc2n(c1=O)cccc2c1onc(n1)c1ccc(cc1)C

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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 C21H22N6O3 MW 406.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N6O3/c1-3-4-11-22-17(28)13-27-21(29)26-12-5-6-16(19(26)24-27)20-23-18(25-30-20)15-9-7-14(2)8-10-15/h5-10,12H,3-4,11,13H2,1-2H3,(H,22,28)
InChIKey
XFLMJUIIPQANFH-UHFFFAOYSA-N
Synonyms

CCCCNC(=O)CN1C(=O)N2C=CC=C(C2=N1)C3=NC(=NO3)C4=CC=C(C=C4)C
InChI=1SC21H22N6O3c134112217(28)132721(29)26125616(19(26)2427)202318(253020)159714(2)81015h51012H341113H212H3(H2228)
MFCD18199986
Nbutyl2(8(3(4methylphenyl)124oxadiazol5yl)3oxo(124)triazolo(43a)pyridin2(3H)yl)acetamide
Nbutyl2(8(3(4methylphenyl)124oxadiazol5yl)3oxo(124)triazolo(43a)pyridin2yl)acetamide
ZINC000057503405
ZINC57503405

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Available files

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