Vitas-M small molecule compound
3-(2,4-dichlorophenyl)-5-[(4-{(E)-[2-(2,4-dinitrophenyl)hydrazinylidene]methyl}-2-nitrophenyl)sulfanyl]-4H-1,2,4-triazole
Catalog ID
STL510874
SMILES Clc1ccc(c(c1)Cl)c1nnc([nH]1)Sc1ccc(cc1[N+](=O)[O-])/C=N/Nc1ccc(cc1[N+](=O)[O-])[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 C21H12Cl2N8O6S MW 575.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H12Cl2N8O6S/c22-12-2-4-14(15(23)8-12)20-25-21(28-27-20)38-19-6-1-11(7-18(19)31(36)37)10-24-26-16-5-3-13(29(32)33)9-17(16)30(34)35/h1-10,26H,(H,25,27,28)/b24-10+InChIKey
LOYMAKIQBPLFFC-YSURURNPSA-NSynonyms
~(N)((~(E))(4((5(24dichlorophenyl)1~(H)124triazol3yl)sulfanyl)3nitrophenyl)methylideneamino)24dinitroaniline
21229751
3(24dichlorophenyl)5((4((E)(2(24dinitrophenyl)hydrazinylidene)methyl)2nitrophenyl)sulfanyl)4H124triazole
InChI=1SC21H12Cl2N8O6Sc22122414(15(23)812)202521(282720)38196111(718(19)31(36)37)102426165313(29(32)33)917(16)30(34)35h11026H(H252728)b2410+
MFCD04568504
ZINC000103698183
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