Vitas-M small molecule compound
4-[(E)-(2-{[1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(phenoxymethyl)-1H-1,2,3-triazol-4-yl]carbonyl}hydrazinylidene)methyl]-2,6-dimethoxyphenyl acetate
Catalog ID
STK549746
SMILES COc1cc(/C=N/NC(=O)c2nnn(c2COc2ccccc2)c2nonc2N)cc(c1OC(=O)C)OC
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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 C23H22N8O7 MW 522.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22N8O7/c1-13(32)37-20-17(34-2)9-14(10-18(20)35-3)11-25-27-23(33)19-16(12-36-15-7-5-4-6-8-15)31(30-26-19)22-21(24)28-38-29-22/h4-11H,12H2,1-3H3,(H2,24,28)(H,27,33)/b25-11+InChIKey
VCHJNAXVLFAIPP-OPEKNORGSA-NSynonyms
835911-77-8(4((E)((1(4amino125oxadiazol3yl)5(phenoxymethyl)triazole4carbonyl)hydrazinylidene)methyl)26dimethoxyphenyl)acetate
(E)4((2(1(4amino125oxadiazol3yl)5(phenoxymethyl)1H123triazole4carbonyl)hydrazono)methyl)26dimethoxyphenylacetate
4((E)(2((1(4amino125oxadiazol3yl)5(phenoxymethyl)1H123triazol4yl)carbonyl)hydrazinylidene)methyl)26dimethoxyphenylacetate
835911778
CC(=O)OC1=C(C=C(C=C1OC)C=NNC(=O)C2=C(N(N=N2)C3=NON=C3N)COC4=CC=CC=C4)OC
COc1cc(C=NNC(=O)c2nnn(c2COc2ccccc2)c2nonc2N)cc(c1OC(=O)C)OC
InChI=1SC23H22N8O7c113(32)372017(342)914(1018(20)353)11252723(33)1916(1236157546815)31(302619)2221(24)28382922h411H12H213H3(H22428)(H2733)b2511+
MFCD03324252
ZINC000101006753
ZINC102454177
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