Vitas-M small molecule compound
1-(4-amino-1,2,5-oxadiazol-3-yl)-5-{[cyclohexyl(methyl)amino]methyl}-N'-[(1E,2E)-3-phenylprop-2-en-1-ylidene]-1H-1,2,3-triazole-4-carbohydrazide
Catalog ID
STL347805
SMILES CN(C1CCCCC1)Cc1c(nnn1c1nonc1N)C(=O)N/N=C/C=C/c1ccccc1
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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 C22H27N9O2 MW 449.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H27N9O2/c1-30(17-12-6-3-7-13-17)15-18-19(25-29-31(18)21-20(23)27-33-28-21)22(32)26-24-14-8-11-16-9-4-2-5-10-16/h2,4-5,8-11,14,17H,3,6-7,12-13,15H2,1H3,(H2,23,27)(H,26,32)/b11-8+,24-14+InChIKey
NAMBJJZMZSDYFV-AGPUXGRSSA-NSynonyms
861148-07-4(E)1(4amino125oxadiazol3yl)5((cyclohexyl(methyl)amino)methyl)N((E)3phenylallylidene)1H123triazole4carbohydrazide
1(4amino125oxadiazol3yl)5((cyclohexyl(methyl)amino)methyl)N((1E2E)3phenylprop2en1ylidene)1H123triazole4carbohydrazide
1(4amino125oxadiazol3yl)5((cyclohexyl(methyl)amino)methyl)N((E)((E)3phenylprop2enylidene)amino)triazole4carboxamide
861148074
CN(C1CCCCC1)Cc1c(nnn1c1nonc1N)C(=O)NN=CC=Cc1ccccc1
CN(CC1=C(N=NN1C2=NON=C2N)C(=O)NN=CC=CC3=CC=CC=C3)C4CCCCC4
InChI=1SC22H27N9O2c130(17126371317)151819(252931(18)2120(23)27332821)22(32)2624148111694251016h2458111417H367121315H21H3(H22327)(H2632)b118+2414+
MFCD05684355
ZINC000009308247
ZINC33574116
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