Vitas-M small molecule compound
methyl (2E)-[(4,5-diphenyl-4H-1,2,4-triazol-3-yl)sulfanyl][2-(4-nitrophenyl)hydrazinylidene]ethanoate
Catalog ID
STK998854
SMILES COC(=O)/C(=N\Nc1ccc(cc1)[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 C23H18N6O4S MW 474.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H18N6O4S/c1-33-22(30)21(26-24-17-12-14-19(15-13-17)29(31)32)34-23-27-25-20(16-8-4-2-5-9-16)28(23)18-10-6-3-7-11-18/h2-15,24H,1H3/b26-21+InChIKey
IBXGRFRXLLGABV-YYADALCUSA-NSynonyms
669761-27-7(E)methyl2((45diphenyl4H124triazol3yl)thio)2(2(4nitrophenyl)hydrazono)acetate
669761277
COC(=O)C(=NNC1=CC=C(C=C1)(N+)(=O)(O))SC2=NN=C(N2C3=CC=CC=C3)C4=CC=CC=C4
COC(=O)C(=NNc1ccc(cc1)(N+)(=O)(O))Sc1nnc(n1c1ccccc1)c1ccccc1
InChI=1SC23H18N6O4Sc13322(30)21(262417121419(151317)29(31)32)3423272520(168425916)28(23)18106371118h21524H1H3b2621+
methyl(2E)((45diphenyl4H124triazol3yl)sulfanyl)(2(4nitrophenyl)hydrazinylidene)ethanoate
methyl(2E)2((45diphenyl124triazol3yl)sulfanyl)2((4nitrophenyl)hydrazinylidene)acetate
MFCD03671813
ZINC000009075574
ZINC97464825
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