Vitas-M small molecule compound
methyl 4-[(E)-(2-{[1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(4-ethoxyphenyl)-1H-1,2,3-triazol-4-yl]carbonyl}hydrazinylidene)methyl]benzoate
Catalog ID
STL004589
SMILES CCOc1ccc(cc1)c1c(nnn1c1nonc1N)C(=O)N/N=C/c1ccc(cc1)C(=O)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 C22H20N8O5 MW 476.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20N8O5/c1-3-34-16-10-8-14(9-11-16)18-17(25-29-30(18)20-19(23)27-35-28-20)21(31)26-24-12-13-4-6-15(7-5-13)22(32)33-2/h4-12H,3H2,1-2H3,(H2,23,27)(H,26,31)/b24-12+InChIKey
MBNGOVCUWKDGAM-WYMPLXKRSA-NSynonyms
840513-35-1(E)methyl4((2(1(4amino125oxadiazol3yl)5(4ethoxyphenyl)1H123triazole4carbonyl)hydrazono)methyl)benzoate
840513351
CCOC1=CC=C(C=C1)C2=C(N=NN2C3=NON=C3N)C(=O)NN=CC4=CC=C(C=C4)C(=O)OC
CCOc1ccc(cc1)c1c(nnn1c1nonc1N)C(=O)NN=Cc1ccc(cc1)C(=O)OC
InChI=1SC22H20N8O5c13341610814(91116)1817(252930(18)2019(23)27352820)21(31)262412134615(7513)22(32)332h412H3H212H3(H22327)(H2631)b2412+
METHYL4((E)((1(4AMINO125OXADIAZOL3YL)5(4ETHOXYPHENYL)TRIAZOLE4CARBONYL)HYDRAZINYLIDENE)METHYL)BENZOATE
methyl4((E)(2((1(4amino125oxadiazol3yl)5(4ethoxyphenyl)1H123triazol4yl)carbonyl)hydrazinylidene)methyl)benzoate
MFCD04009951
ZINC000002193626
ZINC33350030
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