Vitas-M small molecule compound

1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(2,5-dimethoxyphenyl)methylidene]-5-{[methyl(phenyl)amino]methyl}-1H-1,2,3-triazole-4-carbohydrazide

Catalog ID
STL057578
SMILES COc1ccc(c(c1)/C=N/NC(=O)c1nnn(c1CN(c1ccccc1)C)c1nonc1N)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 C22H23N9O4 MW 477.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23N9O4/c1-30(15-7-5-4-6-8-15)13-17-19(25-29-31(17)21-20(23)27-35-28-21)22(32)26-24-12-14-11-16(33-2)9-10-18(14)34-3/h4-12H,13H2,1-3H3,(H2,23,27)(H,26,32)/b24-12+
InChIKey
SLYUWMVSURWUSW-WYMPLXKRSA-N
Synonyms
850825-54-6
(E)1(4amino125oxadiazol3yl)N(25dimethoxybenzylidene)5((methyl(phenyl)amino)methyl)1H123triazole4carbohydrazide
1(4amino125oxadiazol3yl)N((E)(25dimethoxyphenyl)methylidene)5((methyl(phenyl)amino)methyl)1H123triazole4carbohydrazide
1(4AMINO125OXADIAZOL3YL)N((E)(25DIMETHOXYPHENYL)METHYLIDENEAMINO)5((NMETHYLANILINO)METHYL)TRIAZOLE4CARBOXAMIDE
850825546
CN(CC1=C(N=NN1C2=NON=C2N)C(=O)NN=CC3=C(C=CC(=C3)OC)OC)C4=CC=CC=C4
COc1ccc(c(c1)C=NNC(=O)c1nnn(c1CN(c1ccccc1)C)c1nonc1N)OC
InChI=1SC22H23N9O4c130(157546815)131719(252931(17)2120(23)27352821)22(32)262412141116(332)91018(14)343h412H13H213H3(H22327)(H2632)b2412+
MFCD05694172
ZINC000002416079
ZINC33367553

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Available files

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