Vitas-M small molecule compound
1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(3,4-dimethoxyphenyl)methylidene]-5-(4-methylphenyl)-1H-1,2,3-triazole-4-carbohydrazide
Catalog ID
STL004429
SMILES COc1cc(/C=N/NC(=O)c2nnn(c2c2ccc(cc2)C)c2nonc2N)ccc1OC
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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/c1-12-4-7-14(8-5-12)18-17(24-28-29(18)20-19(22)26-33-27-20)21(30)25-23-11-13-6-9-15(31-2)16(10-13)32-3/h4-11H,1-3H3,(H2,22,26)(H,25,30)/b23-11+InChIKey
UBINSCJKCNKLSO-FOKLQQMPSA-NSynonyms
840513-05-5(E)1(4amino125oxadiazol3yl)N(34dimethoxybenzylidene)5(ptolyl)1H123triazole4carbohydrazide
1(4amino125oxadiazol3yl)N((E)(34dimethoxyphenyl)methylidene)5(4methylphenyl)1H123triazole4carbohydrazide
1(4amino125oxadiazol3yl)N((E)(34dimethoxyphenyl)methylideneamino)5(4methylphenyl)triazole4carboxamide
840513055
CC1=CC=C(C=C1)C2=C(N=NN2C3=NON=C3N)C(=O)NN=CC4=CC(=C(C=C4)OC)OC
COc1cc(C=NNC(=O)c2nnn(c2c2ccc(cc2)C)c2nonc2N)ccc1OC
InChI=1SC21H20N8O4c1124714(8512)1817(242829(18)2019(22)26332720)21(30)252311136915(312)16(1013)323h411H13H3(H22226)(H2530)b2311+
MFCD04009890
ZINC000013510511
ZINC33935547
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