Vitas-M small molecule compound
5-amino-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-{[2-(4-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl}-1H-1,2,3-triazole-4-carboxamide
Catalog ID
STL083635
SMILES COc1ccc(cc1)c1nc(c(o1)C)Cn1nnc(c1N)C(=O)Nc1ccc2c(c1)OCCO2
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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 C23H22N6O5 MW 462.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22N6O5/c1-13-17(26-23(34-13)14-3-6-16(31-2)7-4-14)12-29-21(24)20(27-28-29)22(30)25-15-5-8-18-19(11-15)33-10-9-32-18/h3-8,11H,9-10,12,24H2,1-2H3,(H,25,30)InChIKey
IXUUOSQXKMUROI-UHFFFAOYSA-NSynonyms
1112434-13-51112434135
5aminoN(23dihydro14benzodioxin6yl)1((2(4methoxyphenyl)5methyl13oxazol4yl)methyl)1H123triazole4carboxamide
5aminoN(23dihydro14benzodioxin6yl)1((2(4methoxyphenyl)5methyl13oxazol4yl)methyl)triazole4carboxamide
CC1=C(N=C(O1)C2=CC=C(C=C2)OC)CN3C(=C(N=N3)C(=O)NC4=CC5=C(C=C4)OCCO5)N
InChI=1SC23H22N6O5c11317(2623(3413)143616(312)7414)122921(24)20(272829)22(30)2515581819(1115)331093218h3811H9101224H212H3(H2530)
MFCD18202382
ZINC000033291853
ZINC33291853
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