Vitas-M small molecule compound
1-(4-amino-1,2,5-oxadiazol-3-yl)-5-{[cyclohexyl(methyl)amino]methyl}-N'-[(E)-(2,3-dimethoxyphenyl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide
Catalog ID
STL348057
SMILES COc1c(/C=N/NC(=O)c2nnn(c2CN(C2CCCCC2)C)c2nonc2N)cccc1OC
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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 C22H29N9O4 MW 483.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H29N9O4/c1-30(15-9-5-4-6-10-15)13-16-18(25-29-31(16)21-20(23)27-35-28-21)22(32)26-24-12-14-8-7-11-17(33-2)19(14)34-3/h7-8,11-12,15H,4-6,9-10,13H2,1-3H3,(H2,23,27)(H,26,32)/b24-12+InChIKey
UABSJQRCLXKOQJ-WYMPLXKRSA-NSynonyms
861638-96-2(E)1(4amino125oxadiazol3yl)5((cyclohexyl(methyl)amino)methyl)N(23dimethoxybenzylidene)1H123triazole4carbohydrazide
1(4amino125oxadiazol3yl)5((cyclohexyl(methyl)amino)methyl)N((E)(23dimethoxyphenyl)methylidene)1H123triazole4carbohydrazide
1(4amino125oxadiazol3yl)5((cyclohexyl(methyl)amino)methyl)N((E)(23dimethoxyphenyl)methylideneamino)triazole4carboxamide
861638962
CN(CC1=C(N=NN1C2=NON=C2N)C(=O)NN=CC3=C(C(=CC=C3)OC)OC)C4CCCCC4
InChI=1SC22H29N9O4c130(1595461015)131618(252931(16)2120(23)27352821)22(32)26241214871117(332)19(14)343h78111215H4691013H213H3(H22327)(H2632)b2412+
MFCD05685672
ZINC000013804938
ZINC59816503
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