Vitas-M small molecule compound
1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-{4-[(4-chlorobenzyl)oxy]-3-methoxyphenyl}methylidene]-5-[(4-methylpiperidin-1-yl)methyl]-1H-1,2,3-triazole-4-carbohydrazide
Catalog ID
STK548901
SMILES COc1cc(/C=N/NC(=O)c2nnn(c2CN2CCC(CC2)C)c2nonc2N)ccc1OCc1ccc(cc1)Cl
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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 C27H30ClN9O4 MW 580.05 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H30ClN9O4/c1-17-9-11-36(12-10-17)15-21-24(31-35-37(21)26-25(29)33-41-34-26)27(38)32-30-14-19-5-8-22(23(13-19)39-2)40-16-18-3-6-20(28)7-4-18/h3-8,13-14,17H,9-12,15-16H2,1-2H3,(H2,29,33)(H,32,38)/b30-14+InChIKey
YRPYQZQPJNDKJK-AMVVHIIESA-NSynonyms
(E)1(4amino125oxadiazol3yl)N(4((4chlorobenzyl)oxy)3methoxybenzylidene)5((4methylpiperidin1yl)methyl)1H123triazole4carbohydrazide
1(4amino125oxadiazol3yl)N((E)(4((4chlorobenzyl)oxy)3methoxyphenyl)methylidene)5((4methylpiperidin1yl)methyl)1H123triazole4carbohydrazide
1(4amino125oxadiazol3yl)N((E)(4((4chlorophenyl)methoxy)3methoxyphenyl)methylideneamino)5((4methylpiperidin1yl)methyl)triazole4carboxamide
CC1CCN(CC1)CC2=C(N=NN2C3=NON=C3N)C(=O)NN=CC4=CC(=C(C=C4)OCC5=CC=C(C=C5)Cl)OC
COc1cc(C=NNC(=O)c2nnn(c2CN2CCC(CC2)C)c2nonc2N)ccc1OCc1ccc(cc1)Cl
InChI=1SC27H30ClN9O4c11791136(121017)152124(313537(21)2625(29)33413426)27(38)323014195822(23(1319)392)4016183620(28)7418h38131417H9121516H212H3(H22933)(H3238)b3014+
MFCD03287160
ZINC000097966673
ZINC102451946
Check stock
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Check stock on Vitas-MAvailable files
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