Vitas-M small molecule compound
methyl 4-[(E)-(2-{[(4,5-diphenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetyl}hydrazinylidene)methyl]benzoate
Catalog ID
STK049897
SMILES COC(=O)c1ccc(cc1)/C=N/NC(=O)CSc1nnc(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 C25H21N5O3S MW 471.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21N5O3S/c1-33-24(32)20-14-12-18(13-15-20)16-26-27-22(31)17-34-25-29-28-23(19-8-4-2-5-9-19)30(25)21-10-6-3-7-11-21/h2-16H,17H2,1H3,(H,27,31)/b26-16+InChIKey
IGWGUNNBLIIWQN-WGOQTCKBSA-NSynonyms
306756-18-3(E)methyl4((2(2((45diphenyl4H124triazol3yl)thio)acetyl)hydrazono)methyl)benzoate
306756183
COC(=O)C1=CC=C(C=C1)C=NNC(=O)CSC2=NN=C(N2C3=CC=CC=C3)C4=CC=CC=C4
COC(=O)c1ccc(cc1)C=NNC(=O)CSc1nnc(n1c1ccccc1)c1ccccc1
InChI=1SC25H21N5O3Sc13324(32)20141218(131520)16262722(31)173425292823(198425919)30(25)21106371121h216H17H21H3(H2731)b2616+
METHYL4((1E)2(2(45DIPHENYL(124TRIAZOL3YLTHIO))ACETYLAMINO)2AZAVINYL)BENZOATE
METHYL4((E)((2((45DIPHENYL124TRIAZOL3YL)SULFANYL)ACETYL)HYDRAZINYLIDENE)METHYL)BENZOATE
METHYL4((E)(2(((45DIPHENYL4H124TRIAZOL3YL)SULFANYL)ACETYL)HYDRAZINYLIDENE)METHYL)BENZOATE
MFCD01583470
STK049897
ZINC000001207504
ZINC33322332
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.