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3-{(E)-[2-({1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(4-methylpiperidin-1-yl)methyl]-1H-1,2,3-triazol-4-yl}carbonyl)hydrazinylidene]methyl}phenyl 4-chloro-3-nitrobenzoate

Catalog ID
STK545976
SMILES CC1CCN(CC1)Cc1c(nnn1c1nonc1N)C(=O)N/N=C/c1cccc(c1)OC(=O)c1ccc(c(c1)[N+](=O)[O-])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 C26H25ClN10O6 MW 609.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25ClN10O6/c1-15-7-9-35(10-8-15)14-21-22(30-34-36(21)24-23(28)32-43-33-24)25(38)31-29-13-16-3-2-4-18(11-16)42-26(39)17-5-6-19(27)20(12-17)37(40)41/h2-6,11-13,15H,7-10,14H2,1H3,(H2,28,32)(H,31,38)/b29-13+
InChIKey
AWKSYEMKODPQKJ-VFLNYLIXSA-N
Synonyms

(3((E)((1(4amino125oxadiazol3yl)5((4methylpiperidin1yl)methyl)triazole4carbonyl)hydrazinylidene)methyl)phenyl)4chloro3nitrobenzoate
(E)3((2(1(4amino125oxadiazol3yl)5((4methylpiperidin1yl)methyl)1H123triazole4carbonyl)hydrazono)methyl)phenyl4chloro3nitrobenzoate
3((E)(2((1(4amino125oxadiazol3yl)5((4methylpiperidin1yl)methyl)1H123triazol4yl)carbonyl)hydrazinylidene)methyl)phenyl4chloro3nitrobenzoate
CC1CCN(CC1)Cc1c(nnn1c1nonc1N)C(=O)NN=Cc1cccc(c1)OC(=O)c1ccc(c(c1)(N+)(=O)(O))Cl
CC1CCN(CC1)CC2=C(N=NN2C3=NON=C3N)C(=O)NN=CC4=CC(=CC=C4)OC(=O)C5=CC(=C(C=C5)Cl)(N+)(=O)(O)
InChI=1SC26H25ClN10O6c1157935(10815)142122(303436(21)2423(28)32433324)25(38)3129131632418(1116)4226(39)175619(27)20(1217)37(40)41h26111315H71014H21H3(H22832)(H3138)b2913+
MFCD03324491
ZINC000102443207
ZINC102443204

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Available files

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