Vitas-M small molecule compound

2-{4-[(1E)-1-(2-{[1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(4-ethoxyphenyl)-1H-1,2,3-triazol-4-yl]carbonyl}hydrazinylidene)ethyl]phenoxy}acetamide

Catalog ID
STL002464
SMILES CCOc1ccc(cc1)c1c(nnn1c1nonc1N)C(=O)N/N=C(/c1ccc(cc1)OCC(=O)N)\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 C23H23N9O5 MW 505.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H23N9O5/c1-3-35-16-10-6-15(7-11-16)20-19(27-31-32(20)22-21(25)29-37-30-22)23(34)28-26-13(2)14-4-8-17(9-5-14)36-12-18(24)33/h4-11H,3,12H2,1-2H3,(H2,24,33)(H2,25,29)(H,28,34)/b26-13+
InChIKey
IILCQDLSVVNMHK-LGJNPRDNSA-N
Synonyms
573933-76-3
(E)2(4(1(2(1(4amino125oxadiazol3yl)5(4ethoxyphenyl)1H123triazole4carbonyl)hydrazono)ethyl)phenoxy)acetamide
1(4amino125oxadiazol3yl)N((E)1(4(2amino2oxoethoxy)phenyl)ethylideneamino)5(4ethoxyphenyl)triazole4carboxamide
2(4((1E)1(2((1(4amino125oxadiazol3yl)5(4ethoxyphenyl)1H123triazol4yl)carbonyl)hydrazinylidene)ethyl)phenoxy)acetamide
573933763
CCOC1=CC=C(C=C1)C2=C(N=NN2C3=NON=C3N)C(=O)NN=C(C)C4=CC=C(C=C4)OCC(=O)N
CCOc1ccc(cc1)c1c(nnn1c1nonc1N)C(=O)NN=C(c1ccc(cc1)OCC(=O)N)C
InChI=1SC23H23N9O5c13351610615(71116)2019(273132(20)2221(25)29373022)23(34)282613(2)144817(9514)361218(24)33h411H312H212H3(H22433)(H22529)(H2834)b2613+
MFCD04019858
ZINC000013514541
ZINC34378490

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Available files

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