Vitas-M small molecule compound
1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-{(E)-[4-(benzyloxy)-3-methoxyphenyl]methylidene}-5-methyl-1H-1,2,3-triazole-4-carbohydrazide
Catalog ID
STK548050
SMILES COc1cc(/C=N/NC(=O)c2nnn(c2C)c2nonc2N)ccc1OCc1ccccc1
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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 C21H20N8O4 MW 448.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N8O4/c1-13-18(24-28-29(13)20-19(22)26-33-27-20)21(30)25-23-11-15-8-9-16(17(10-15)31-2)32-12-14-6-4-3-5-7-14/h3-11H,12H2,1-2H3,(H2,22,26)(H,25,30)/b23-11+InChIKey
CEQYFXPCUIJGCV-FOKLQQMPSA-NSynonyms
500103-83-3(E)1(4amino125oxadiazol3yl)N(4(benzyloxy)3methoxybenzylidene)5methyl1H123triazole4carbohydrazide
1(4AMINO125OXADIAZOL3YL)N((E)(3METHOXY4PHENYLMETHOXYPHENYL)METHYLIDENEAMINO)5METHYLTRIAZOLE4CARBOXAMIDE
1(4amino125oxadiazol3yl)N((E)(4(benzyloxy)3methoxyphenyl)methylidene)5methyl1H123triazole4carbohydrazide
500103833
CC1=C(N=NN1C2=NON=C2N)C(=O)NN=CC3=CC(=C(C=C3)OCC4=CC=CC=C4)OC
COc1cc(C=NNC(=O)c2nnn(c2C)c2nonc2N)ccc1OCc1ccccc1
InChI=1SC21H20N8O4c11318(242829(13)2019(22)26332720)21(30)252311158916(17(1015)312)3212146435714h311H12H212H3(H22226)(H2530)b2311+
MFCD03303938
ZINC000002357333
ZINC102449616
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