Vitas-M small molecule compound
1-(4-amino-1,2,5-oxadiazol-3-yl)-5-{[cyclohexyl(methyl)amino]methyl}-N'-[(E)-(2,4-dimethoxyphenyl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide
Catalog ID
STL346911
SMILES COc1cc(OC)ccc1/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 C22H29N9O4 MW 483.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H29N9O4/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)26-24-12-14-9-10-16(33-2)11-18(14)34-3/h9-12,15H,4-8,13H2,1-3H3,(H2,23,27)(H,26,32)/b24-12+InChIKey
UWUPAAUSEQZYHJ-WYMPLXKRSA-NSynonyms
849000-10-8(E)1(4amino125oxadiazol3yl)5((cyclohexyl(methyl)amino)methyl)N(24dimethoxybenzylidene)1H123triazole4carbohydrazide
1(4amino125oxadiazol3yl)5((cyclohexyl(methyl)amino)methyl)N((E)(24dimethoxyphenyl)methylidene)1H123triazole4carbohydrazide
1(4AMINO125OXADIAZOL3YL)5((CYCLOHEXYL(METHYL)AMINO)METHYL)N((E)(24DIMETHOXYPHENYL)METHYLIDENEAMINO)TRIAZOLE4CARBOXAMIDE
849000108
CN(CC1=C(N=NN1C2=NON=C2N)C(=O)NN=CC3=C(C=C(C=C3)OC)OC)C4CCCCC4
InChI=1SC22H29N9O4c130(157546815)131719(252931(17)2120(23)27352821)22(32)2624121491016(332)1118(14)343h91215H4813H213H3(H22327)(H2632)b2412+
MFCD05679784
ZINC000002448852
ZINC33372752
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