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2-{(E)-[2-({1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(4-methylpiperazin-1-yl)methyl]-1H-1,2,3-triazol-4-yl}carbonyl)hydrazinylidene]methyl}-6-methoxyphenyl benzoate

Catalog ID
STK548854
SMILES COc1cccc(c1OC(=O)c1ccccc1)/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 C26H28N10O5 MW 560.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H28N10O5/c1-34-11-13-35(14-12-34)16-19-21(29-33-36(19)24-23(27)31-41-32-24)25(37)30-28-15-18-9-6-10-20(39-2)22(18)40-26(38)17-7-4-3-5-8-17/h3-10,15H,11-14,16H2,1-2H3,(H2,27,31)(H,30,37)/b28-15+
InChIKey
XJHZGTRLHPDRDC-RWPZCVJISA-N
Synonyms

(2((E)((1(4amino125oxadiazol3yl)5((4methylpiperazin1yl)methyl)triazole4carbonyl)hydrazinylidene)methyl)6methoxyphenyl)benzoate
(E)2((2(1(4amino125oxadiazol3yl)5((4methylpiperazin1yl)methyl)1H123triazole4carbonyl)hydrazono)methyl)6methoxyphenylbenzoate
2((E)(2((1(4amino125oxadiazol3yl)5((4methylpiperazin1yl)methyl)1H123triazol4yl)carbonyl)hydrazinylidene)methyl)6methoxyphenylbenzoate
CN1CCN(CC1)CC2=C(N=NN2C3=NON=C3N)C(=O)NN=CC4=C(C(=CC=C4)OC)OC(=O)C5=CC=CC=C5
COc1cccc(c1OC(=O)c1ccccc1)C=NNC(=O)c1nnn(c1CN1CCN(CC1)C)c1nonc1N
InChI=1SC26H28N10O5c134111335(141234)161921(293336(19)2423(27)31413224)25(37)30281518961020(392)22(18)4026(38)177435817h31015H111416H212H3(H22731)(H3037)b2815+
MFCD03289495
ZINC000097966672
ZINC102451852

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Available files

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