Vitas-M small molecule compound

N'-{(E)-[4-(diethylamino)-2-hydroxyphenyl]methylidene}-2-[(4,5-diphenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetohydrazide

Catalog ID
STK077731
SMILES CCN(c1ccc(c(c1)O)/C=N/NC(=O)CSc1nnc(n1c1ccccc1)c1ccccc1)CC

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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 C27H28N6O2S MW 500.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H28N6O2S/c1-3-32(4-2)23-16-15-21(24(34)17-23)18-28-29-25(35)19-36-27-31-30-26(20-11-7-5-8-12-20)33(27)22-13-9-6-10-14-22/h5-18,34H,3-4,19H2,1-2H3,(H,29,35)/b28-18+
InChIKey
ZNOBGLPFQARKLL-MTDXEUNCSA-N
Synonyms
306756-32-1
(E)N(4(diethylamino)2hydroxybenzylidene)2((45diphenyl4H124triazol3yl)thio)acetohydrazide
5(DIETHYLAMMONIO)2((E)(2(((45DIPHENYL4H124TRIAZOL3YL)SULFANYL)ACETYL)HYDRAZINYLIDENE)METHYL)PHENOLATE
5(diethylazaniumyl)2((E)((2((45diphenyl124triazol3yl)sulfanyl)acetyl)hydrazinylidene)methyl)phenolate
CC(NH+)(CC)C1=CC(=C(C=C1)C=NNC(=O)CSC2=NN=C(N2C3=CC=CC=C3)C4=CC=CC=C4)(O)
CCN(c1ccc(c(c1)O)C=NNC(=O)CSc1nnc(n1c1ccccc1)c1ccccc1)CC
InChI=1SC27H28N6O2Sc1332(42)23161521(24(34)1723)18282925(35)193627313026(20117581220)33(27)221396101422h51834H3419H212H3(H2935)b2818+
N((E)(4(diethylamino)2hydroxyphenyl)methylidene)2((45diphenyl4H124triazol3yl)sulfanyl)acetohydrazide
STK077731
ZINC000001835866

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.