Vitas-M small molecule compound
1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-cyclohex-3-en-1-ylmethylidene]-5-{[cyclohexyl(methyl)amino]methyl}-1H-1,2,3-triazole-4-carbohydrazide
Catalog ID
STL001985
SMILES CN(C1CCCCC1)Cc1c(nnn1c1nonc1N)C(=O)N/N=C/C1CCC=CC1
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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 C20H29N9O2 MW 427.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H29N9O2/c1-28(15-10-6-3-7-11-15)13-16-17(23-27-29(16)19-18(21)25-31-26-19)20(30)24-22-12-14-8-4-2-5-9-14/h2,4,12,14-15H,3,5-11,13H2,1H3,(H2,21,25)(H,24,30)/b22-12+InChIKey
OUWDEOWXBGEVCU-WSDLNYQXSA-NSynonyms
861117-40-0(E)1(4amino125oxadiazol3yl)N(cyclohex3en1ylmethylene)5((cyclohexyl(methyl)amino)methyl)1H123triazole4carbohydrazide
1(4amino125oxadiazol3yl)N((E)cyclohex3en1ylmethylidene)5((cyclohexyl(methyl)amino)methyl)1H123triazole4carbohydrazide
1(4amino125oxadiazol3yl)N((E)cyclohex3en1ylmethylideneamino)5((cyclohexyl(methyl)amino)methyl)triazole4carboxamide
861117400
CN(C1CCCCC1)Cc1c(nnn1c1nonc1N)C(=O)NN=CC1CCC=CC1
CN(CC1=C(N=NN1C2=NON=C2N)C(=O)NN=CC3CCC=CC3)C4CCCCC4
InChI=1SC20H29N9O2c128(15106371115)131617(232729(16)1918(21)25312619)20(30)242212148425914h24121415H351113H21H3(H22125)(H2430)b2212+
MFCD05683052
ZINC000009307579
ZINC000009307580
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