Vitas-M small molecule compound
1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-{3-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]-4-methoxyphenyl}methylidene]-5-[(4-methylpiperazin-1-yl)methyl]-1H-1,2,3-triazole-4-carbohydrazide
Catalog ID
STK545721
SMILES COc1ccc(cc1Cn1nc(c(c1C)Br)C)/C=N/NC(=O)c1nnn(c1CN1CCN(CC1)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 C25H31BrN12O3 MW 627.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H31BrN12O3/c1-15-21(26)16(2)37(31-15)13-18-11-17(5-6-20(18)40-4)12-28-30-25(39)22-19(14-36-9-7-35(3)8-10-36)38(34-29-22)24-23(27)32-41-33-24/h5-6,11-12H,7-10,13-14H2,1-4H3,(H2,27,32)(H,30,39)/b28-12+InChIKey
CSRALYKWPWSKFS-KVSWJAHQSA-NSynonyms
(E)1(4amino125oxadiazol3yl)N(3((4bromo35dimethyl1Hpyrazol1yl)methyl)4methoxybenzylidene)5((4methylpiperazin1yl)methyl)1H123triazole4carbohydrazide
1(4amino125oxadiazol3yl)N((E)(3((4bromo35dimethyl1Hpyrazol1yl)methyl)4methoxyphenyl)methylidene)5((4methylpiperazin1yl)methyl)1H123triazole4carbohydrazide
1(4amino125oxadiazol3yl)N((E)(3((4bromo35dimethylpyrazol1yl)methyl)4methoxyphenyl)methylideneamino)5((4methylpiperazin1yl)methyl)triazole4carboxamide
CC1=C(C(=NN1CC2=C(C=CC(=C2)C=NNC(=O)C3=C(N(N=N3)C4=NON=C4N)CN5CCN(CC5)C)OC)C)Br
COc1ccc(cc1Cn1nc(c(c1C)Br)C)C=NNC(=O)c1nnn(c1CN1CCN(CC1)C)c1nonc1N
InChI=1SC25H31BrN12O3c11521(26)16(2)37(3115)13181117(5620(18)404)12283025(39)2219(14369735(3)81036)38(342922)2423(27)32413324h561112H7101314H214H3(H22732)(H3039)b2812+
MFCD03299142
ZINC000097966606
ZINC102442456
Check stock
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