Vitas-M small molecule compound
1-(4-amino-1,2,5-oxadiazol-3-yl)-5-phenyl-N'-[(E)-(2,3,4-trimethoxyphenyl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide
Catalog ID
STK548562
SMILES COc1c(/C=N/NC(=O)c2nnn(c2c2ccccc2)c2nonc2N)ccc(c1OC)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 C21H20N8O5 MW 464.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N8O5/c1-31-14-10-9-13(17(32-2)18(14)33-3)11-23-25-21(30)15-16(12-7-5-4-6-8-12)29(28-24-15)20-19(22)26-34-27-20/h4-11H,1-3H3,(H2,22,26)(H,25,30)/b23-11+InChIKey
ZWHKYYLYLSYYJT-FOKLQQMPSA-NSynonyms
488727-30-6(E)1(4amino125oxadiazol3yl)5phenylN(234trimethoxybenzylidene)1H123triazole4carbohydrazide
1(4amino125oxadiazol3yl)5phenylN((E)(234trimethoxyphenyl)methylidene)1H123triazole4carbohydrazide
1(4AMINO125OXADIAZOL3YL)5PHENYLN((E)(234TRIMETHOXYPHENYL)METHYLIDENEAMINO)TRIAZOLE4CARBOXAMIDE
488727306
COC1=C(C(=C(C=C1)C=NNC(=O)C2=C(N(N=N2)C3=NON=C3N)C4=CC=CC=C4)OC)OC
COc1c(C=NNC(=O)c2nnn(c2c2ccccc2)c2nonc2N)ccc(c1OC)OC
InChI=1SC21H20N8O5c1311410913(17(322)18(14)333)11232521(30)1516(127546812)29(282415)2019(22)26342720h411H13H3(H22226)(H2530)b2311+
MFCD03005490
ZINC000002338526
ZINC33361462
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