Vitas-M small molecule compound
methyl 4-[(E)-(2-{[1-(4-amino-1,2,5-oxadiazol-3-yl)-5-phenyl-1H-1,2,3-triazol-4-yl]carbonyl}hydrazinylidene)methyl]benzoate
Catalog ID
STK546727
SMILES COC(=O)c1ccc(cc1)/C=N/NC(=O)c1nnn(c1c1ccccc1)c1nonc1N
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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 C20H16N8O4 MW 432.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16N8O4/c1-31-20(30)14-9-7-12(8-10-14)11-22-24-19(29)15-16(13-5-3-2-4-6-13)28(27-23-15)18-17(21)25-32-26-18/h2-11H,1H3,(H2,21,25)(H,24,29)/b22-11+InChIKey
VUPWEQGJRJQYDC-SSDVNMTOSA-NSynonyms
497229-42-2(E)methyl4((2(1(4amino125oxadiazol3yl)5phenyl1H123triazole4carbonyl)hydrazono)methyl)benzoate
497229422
COC(=O)C1=CC=C(C=C1)C=NNC(=O)C2=C(N(N=N2)C3=NON=C3N)C4=CC=CC=C4
COC(=O)c1ccc(cc1)C=NNC(=O)c1nnn(c1c1ccccc1)c1nonc1N
InChI=1SC20H16N8O4c13120(30)149712(81014)11222419(29)1516(135324613)28(272315)1817(21)25322618h211H1H3(H22125)(H2429)b2211+
METHYL4((E)((1(4AMINO125OXADIAZOL3YL)5PHENYLTRIAZOLE4CARBONYL)HYDRAZINYLIDENE)METHYL)BENZOATE
methyl4((E)(2((1(4amino125oxadiazol3yl)5phenyl1H123triazol4yl)carbonyl)hydrazinylidene)methyl)benzoate
MFCD03300500
ZINC000002343610
ZINC33361988
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