Vitas-M small molecule compound
4-[(E)-(2-{[1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(propan-2-yl)-1H-1,2,3-triazol-4-yl]carbonyl}hydrazinylidene)methyl]-2-ethoxyphenyl acetate
Catalog ID
STL001886
SMILES CCOc1cc(/C=N/NC(=O)c2nnn(c2C(C)C)c2nonc2N)ccc1OC(=O)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 C19H22N8O5 MW 442.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H22N8O5/c1-5-30-14-8-12(6-7-13(14)31-11(4)28)9-21-23-19(29)15-16(10(2)3)27(26-22-15)18-17(20)24-32-25-18/h6-10H,5H2,1-4H3,(H2,20,24)(H,23,29)/b21-9+InChIKey
DVOUUWNMDADDSV-ZVBGSRNCSA-NSynonyms
840486-42-2(4((E)((1(4AMINO125OXADIAZOL3YL)5PROPAN2YLTRIAZOLE4CARBONYL)HYDRAZINYLIDENE)METHYL)2ETHOXYPHENYL)ACETATE
(E)4((2(1(4amino125oxadiazol3yl)5isopropyl1H123triazole4carbonyl)hydrazono)methyl)2ethoxyphenylacetate
4((E)(2((1(4amino125oxadiazol3yl)5(propan2yl)1H123triazol4yl)carbonyl)hydrazinylidene)methyl)2ethoxyphenylacetate
840486422
CCOC1=C(C=CC(=C1)C=NNC(=O)C2=C(N(N=N2)C3=NON=C3N)C(C)C)OC(=O)C
CCOc1cc(C=NNC(=O)c2nnn(c2C(C)C)c2nonc2N)ccc1OC(=O)C
InChI=1SC19H22N8O5c153014812(6713(14)3111(4)28)9212319(29)1516(10(2)3)27(262215)1817(20)24322518h610H5H214H3(H22024)(H2329)b219+
MFCD04007811
ZINC000002265222
ZINC33351872
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