Vitas-M small molecule compound
2-(4-{(E)-[2-({1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(4-fluorophenoxy)methyl]-1H-1,2,3-triazol-4-yl}carbonyl)hydrazinylidene]methyl}phenoxy)acetamide
Catalog ID
STK557835
SMILES NC(=O)COc1ccc(cc1)/C=N/NC(=O)c1nnn(c1COc1ccc(cc1)F)c1nonc1N
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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 C21H18FN9O5 MW 495.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18FN9O5/c22-13-3-7-15(8-4-13)34-10-16-18(26-30-31(16)20-19(24)28-36-29-20)21(33)27-25-9-12-1-5-14(6-2-12)35-11-17(23)32/h1-9H,10-11H2,(H2,23,32)(H2,24,28)(H,27,33)/b25-9+InChIKey
BOYHRSQNJVJYAT-YCPBAFNGSA-NSynonyms
585552-49-4(E)2(4((2(1(4amino125oxadiazol3yl)5((4fluorophenoxy)methyl)1H123triazole4carbonyl)hydrazono)methyl)phenoxy)acetamide
1(4AMINO125OXADIAZOL3YL)N((E)(4(2AMINO2OXOETHOXY)PHENYL)METHYLIDENEAMINO)5((4FLUOROPHENOXY)METHYL)TRIAZOLE4CARBOXAMIDE
2(4((E)(2((1(4amino125oxadiazol3yl)5((4fluorophenoxy)methyl)1H123triazol4yl)carbonyl)hydrazinylidene)methyl)phenoxy)acetamide
585552494
C1=CC(=CC=C1C=NNC(=O)C2=C(N(N=N2)C3=NON=C3N)COC4=CC=C(C=C4)F)OCC(=O)N
InChI=1SC21H18FN9O5c22133715(8413)34101618(263031(16)2019(24)28362920)21(33)27259121514(6212)351117(23)32h19H1011H2(H22332)(H22428)(H2733)b259+
MFCD03339529
NC(=O)COc1ccc(cc1)C=NNC(=O)c1nnn(c1COc1ccc(cc1)F)c1nonc1N
ZINC000002383267
ZINC33364367
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.