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1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-{4-methoxy-3-[(3-methyl-4-nitrophenoxy)methyl]phenyl}methylidene]-5-[(4-methylpiperazin-1-yl)methyl]-1H-1,2,3-triazole-4-carbohydrazide

Catalog ID
STK548403
SMILES COc1ccc(cc1COc1ccc(c(c1)C)[N+](=O)[O-])/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 C27H31N11O6 MW 605.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H31N11O6/c1-17-12-20(5-6-21(17)38(40)41)43-16-19-13-18(4-7-23(19)42-3)14-29-31-27(39)24-22(15-36-10-8-35(2)9-11-36)37(34-30-24)26-25(28)32-44-33-26/h4-7,12-14H,8-11,15-16H2,1-3H3,(H2,28,32)(H,31,39)/b29-14+
InChIKey
JQFSJMGWPSUCNF-IPPBACCNSA-N
Synonyms

(E)1(4amino125oxadiazol3yl)N(4methoxy3((3methyl4nitrophenoxy)methyl)benzylidene)5((4methylpiperazin1yl)methyl)1H123triazole4carbohydrazide
1(4amino125oxadiazol3yl)N((E)(4methoxy3((3methyl4nitrophenoxy)methyl)phenyl)methylidene)5((4methylpiperazin1yl)methyl)1H123triazole4carbohydrazide
1(4amino125oxadiazol3yl)N((E)(4methoxy3((3methyl4nitrophenoxy)methyl)phenyl)methylideneamino)5((4methylpiperazin1yl)methyl)triazole4carboxamide
CC1=C(C=CC(=C1)OCC2=C(C=CC(=C2)C=NNC(=O)C3=C(N(N=N3)C4=NON=C4N)CN5CCN(CC5)C)OC)(N+)(=O)(O)
COc1ccc(cc1COc1ccc(c(c1)C)(N+)(=O)(O))C=NNC(=O)c1nnn(c1CN1CCN(CC1)C)c1nonc1N
InChI=1SC27H31N11O6c1171220(5621(17)38(40)41)4316191318(4723(19)423)14293127(39)2422(153610835(2)91136)37(343024)2625(28)32443326h471214H8111516H213H3(H22832)(H3139)b2914+
MFCD03295496
ZINC000102450680
ZINC102450673

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Available files

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