Vitas-M small molecule compound
4,5-diphenyl-4H-1,2,4-triazol-3-yl (1E)-N-(2-nitrophenyl)-2-oxopropanehydrazonothioate
Catalog ID
STK733745
SMILES CC(=O)/C(=N\Nc1ccccc1[N+](=O)[O-])/Sc1nnc(n1c1ccccc1)c1ccccc1
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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 C23H18N6O3S MW 458.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H18N6O3S/c1-16(30)22(26-24-19-14-8-9-15-20(19)29(31)32)33-23-27-25-21(17-10-4-2-5-11-17)28(23)18-12-6-3-7-13-18/h2-15,24H,1H3/b26-22+InChIKey
VRWDNRFSGREFEI-XTCLZLMSSA-NSynonyms
(45DIPHENYL124TRIAZOL3YL)(1E)N(2NITROANILINO)2OXOPROPANIMIDOTHIOATE
(E)45diphenyl4H124triazol3ylN(2nitrophenyl)2oxopropanehydrazonothioate
45diphenyl4H124triazol3yl(1E)N(2nitrophenyl)2oxopropanehydrazonothioate
CC(=O)C(=NNC1=CC=CC=C1(N+)(=O)(O))SC2=NN=C(N2C3=CC=CC=C3)C4=CC=CC=C4
CC(=O)C(=NNc1ccccc1(N+)(=O)(O))Sc1nnc(n1c1ccccc1)c1ccccc1
InChI=1SC23H18N6O3Sc116(30)22(26241914891520(19)29(31)32)3323272521(17104251117)28(23)18126371318h21524H1H3b2622+
MFCD02994886
ZINC000008836795
ZINC102659844
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