Vitas-M small molecule compound
2-[(Z)-(2-{[1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(morpholin-4-ylmethyl)-1H-1,2,3-triazol-4-yl]carbonyl}hydrazinylidene)methyl]-6-methoxyphenyl acetate
Catalog ID
STK550738
SMILES COc1cccc(c1OC(=O)C)/C=N\NC(=O)c1nnn(c1CN1CCOCC1)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 C20H23N9O6 MW 485.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23N9O6/c1-12(30)34-17-13(4-3-5-15(17)32-2)10-22-24-20(31)16-14(11-28-6-8-33-9-7-28)29(27-23-16)19-18(21)25-35-26-19/h3-5,10H,6-9,11H2,1-2H3,(H2,21,25)(H,24,31)/b22-10-InChIKey
SUELUFFDTCTHFE-YVNNLAQVSA-NSynonyms
487036-22-6(2((Z)((1(4AMINO125OXADIAZOL3YL)5(MORPHOLIN4YLMETHYL)TRIAZOLE4CARBONYL)HYDRAZINYLIDENE)METHYL)6METHOXYPHENYL)ACETATE
(Z)2((2(1(4amino125oxadiazol3yl)5(morpholinomethyl)1H123triazole4carbonyl)hydrazono)methyl)6methoxyphenylacetate
2((Z)(2((1(4amino125oxadiazol3yl)5(morpholin4ylmethyl)1H123triazol4yl)carbonyl)hydrazinylidene)methyl)6methoxyphenylacetate
487036226
CC(=O)OC1=C(C=CC=C1OC)C=NNC(=O)C2=C(N(N=N2)C3=NON=C3N)CN4CCOCC4
COc1cccc(c1OC(=O)C)C=NNC(=O)c1nnn(c1CN1CCOCC1)c1nonc1N
InChI=1SC20H23N9O6c112(30)341713(43515(17)322)10222420(31)1614(112868339728)29(272316)1918(21)25352619h3510H6911H212H3(H22125)(H2431)b2210
MFCD03693747
ZINC000013714678
ZINC33918508
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