Vitas-M small molecule compound
methyl 4-[(E)-(2-{[1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(4-propoxyphenyl)-1H-1,2,3-triazol-4-yl]carbonyl}hydrazinylidene)methyl]benzoate
Catalog ID
STL349280
SMILES CCCOc1ccc(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 C23H22N8O5 MW 490.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22N8O5/c1-3-12-35-17-10-8-15(9-11-17)19-18(26-30-31(19)21-20(24)28-36-29-21)22(32)27-25-13-14-4-6-16(7-5-14)23(33)34-2/h4-11,13H,3,12H2,1-2H3,(H2,24,28)(H,27,32)/b25-13+InChIKey
DRNFHBKQWMIXOL-DHRITJCHSA-NSynonyms
877796-25-3(E)methyl4((2(1(4amino125oxadiazol3yl)5(4propoxyphenyl)1H123triazole4carbonyl)hydrazono)methyl)benzoate
877796253
CCCOC1=CC=C(C=C1)C2=C(N=NN2C3=NON=C3N)C(=O)NN=CC4=CC=C(C=C4)C(=O)OC
CCCOc1ccc(cc1)c1c(nnn1c1nonc1N)C(=O)NN=Cc1ccc(cc1)C(=O)OC
InChI=1SC23H22N8O5c1312351710815(91117)1918(263031(19)2120(24)28362921)22(32)272513144616(7514)23(33)342h41113H312H212H3(H22428)(H2732)b2513+
METHYL4((E)((1(4AMINO125OXADIAZOL3YL)5(4PROPOXYPHENYL)TRIAZOLE4CARBONYL)HYDRAZINYLIDENE)METHYL)BENZOATE
methyl4((E)(2((1(4amino125oxadiazol3yl)5(4propoxyphenyl)1H123triazol4yl)carbonyl)hydrazinylidene)methyl)benzoate
MFCD05703189
ZINC000009345665
ZINC35225615
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