Vitas-M small molecule compound
1-(4-amino-1,2,5-oxadiazol-3-yl)-5-{[cyclohexyl(methyl)amino]methyl}-N'-[(E)-(4-ethoxyphenyl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide
Catalog ID
STL346620
SMILES CCOc1ccc(cc1)/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 C22H29N9O3 MW 467.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H29N9O3/c1-3-33-17-11-9-15(10-12-17)13-24-26-22(32)19-18(14-30(2)16-7-5-4-6-8-16)31(29-25-19)21-20(23)27-34-28-21/h9-13,16H,3-8,14H2,1-2H3,(H2,23,27)(H,26,32)/b24-13+InChIKey
VRDVGWONLCICRS-ZMOGYAJESA-NSynonyms
848932-57-0(E)1(4amino125oxadiazol3yl)5((cyclohexyl(methyl)amino)methyl)N(4ethoxybenzylidene)1H123triazole4carbohydrazide
1(4amino125oxadiazol3yl)5((cyclohexyl(methyl)amino)methyl)N((E)(4ethoxyphenyl)methylidene)1H123triazole4carbohydrazide
1(4AMINO125OXADIAZOL3YL)5((CYCLOHEXYL(METHYL)AMINO)METHYL)N((E)(4ETHOXYPHENYL)METHYLIDENEAMINO)TRIAZOLE4CARBOXAMIDE
848932570
CCOC1=CC=C(C=C1)C=NNC(=O)C2=C(N(N=N2)C3=NON=C3N)CN(C)C4CCCCC4
InChI=1SC22H29N9O3c13331711915(101217)13242622(32)1918(1430(2)167546816)31(292519)2120(23)27342821h91316H3814H212H3(H22327)(H2632)b2413+
MFCD05678398
ZINC000002445216
ZINC33372580
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