Vitas-M small molecule compound
1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(3-methoxyphenyl)methylidene]-5-{[methyl(phenyl)amino]methyl}-1H-1,2,3-triazole-4-carbohydrazide
Catalog ID
STL056212
SMILES COc1cccc(c1)/C=N/NC(=O)c1nnn(c1CN(c1ccccc1)C)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 C21H21N9O3 MW 447.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21N9O3/c1-29(15-8-4-3-5-9-15)13-17-18(24-28-30(17)20-19(22)26-33-27-20)21(31)25-23-12-14-7-6-10-16(11-14)32-2/h3-12H,13H2,1-2H3,(H2,22,26)(H,25,31)/b23-12+InChIKey
GMAAJDOWKUTLHA-FSJBWODESA-NSynonyms
877796-97-9(E)1(4amino125oxadiazol3yl)N(3methoxybenzylidene)5((methyl(phenyl)amino)methyl)1H123triazole4carbohydrazide
1(4amino125oxadiazol3yl)N((E)(3methoxyphenyl)methylidene)5((methyl(phenyl)amino)methyl)1H123triazole4carbohydrazide
1(4amino125oxadiazol3yl)N((E)(3methoxyphenyl)methylideneamino)5((Nmethylanilino)methyl)triazole4carboxamide
877796979
CN(CC1=C(N=NN1C2=NON=C2N)C(=O)NN=CC3=CC(=CC=C3)OC)C4=CC=CC=C4
COc1cccc(c1)C=NNC(=O)c1nnn(c1CN(c1ccccc1)C)c1nonc1N
InChI=1SC21H21N9O3c129(158435915)131718(242830(17)2019(22)26332720)21(31)25231214761016(1114)322h312H13H212H3(H22226)(H2531)b2312+
MFCD05703318
ZINC000009293491
ZINC33392458
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