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N'-[(E)-(2-chloro-5-nitrophenyl)methylidene]-2-{[4-phenyl-5-(3,4,5-trimethoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazide

Catalog ID
STL412467
SMILES COc1cc(cc(c1OC)OC)c1nnc(n1c1ccccc1)SCC(=O)N/N=C/c1cc(ccc1Cl)[N+](=O)[O-]

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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 C26H23ClN6O6S MW 583.02 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H23ClN6O6S/c1-37-21-12-16(13-22(38-2)24(21)39-3)25-30-31-26(32(25)18-7-5-4-6-8-18)40-15-23(34)29-28-14-17-11-19(33(35)36)9-10-20(17)27/h4-14H,15H2,1-3H3,(H,29,34)/b28-14+
InChIKey
KHJIEWXWNDXNDJ-CCVNUDIWSA-N
Synonyms

(E)N(2chloro5nitrobenzylidene)2((4phenyl5(345trimethoxyphenyl)4H124triazol3yl)thio)acetohydrazide
COC1=CC(=CC(=C1OC)OC)C2=NN=C(N2C3=CC=CC=C3)SCC(=O)NN=CC4=C(C=CC(=C4)(N+)(=O)(O))Cl
COc1cc(cc(c1OC)OC)c1nnc(n1c1ccccc1)SCC(=O)NN=Cc1cc(ccc1Cl)(N+)(=O)(O)
InChI=1SC26H23ClN6O6Sc137211216(1322(382)24(21)393)25303126(32(25)187546818)401523(34)292814171119(33(35)36)91020(17)27h414H15H213H3(H2934)b2814+
MFCD01440962
N((1E)2(2CHLORO5NITROPHENYL)1AZAVINYL)2(4PHENYL5(345TRIMETHOXYPHENYL)(124TRIAZOL3YLTHIO))ACETAMIDE
N((E)(2chloro5nitrophenyl)methylidene)2((4phenyl5(345trimethoxyphenyl)4H124triazol3yl)sulfanyl)acetohydrazide
N((E)(2chloro5nitrophenyl)methylideneamino)2((4phenyl5(345trimethoxyphenyl)124triazol3yl)sulfanyl)acetamide
ZINC000001848986
ZINC103442086

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Available files

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