Vitas-M small molecule compound

2-{[4-(4-methoxyphenyl)-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-methylphenyl)acetamide

Catalog ID
STK575918
SMILES COc1ccc(cc1)n1c(SCC(=O)Nc2ccc(cc2)C)nnc1COc1ccccc1

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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 C25H24N4O3S MW 460.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24N4O3S/c1-18-8-10-19(11-9-18)26-24(30)17-33-25-28-27-23(16-32-22-6-4-3-5-7-22)29(25)20-12-14-21(31-2)15-13-20/h3-15H,16-17H2,1-2H3,(H,26,30)
InChIKey
YKDNTSBBNZKMSJ-UHFFFAOYSA-N
Synonyms
539806-71-8
2((4(4METHOXYPHENYL)5(PHENOXYMETHYL)124TRIAZOL3YL)SULFANYL)N(4METHYLPHENYL)ACETAMIDE
2((4(4methoxyphenyl)5(phenoxymethyl)4H124triazol3yl)sulfanyl)N(4methylphenyl)acetamide
2((4(4methoxyphenyl)5(phenoxymethyl)4H124triazol3yl)thio)N(ptolyl)acetamide
2(4(4METHOXYPHENYL)5(PHENOXYMETHYL)(124TRIAZOL3YLTHIO))N(4METHYLPHENYL)ACETAMIDE
539806718
CC1=CC=C(C=C1)NC(=O)CSC2=NN=C(N2C3=CC=C(C=C3)OC)COC4=CC=CC=C4
InChI=1SC25H24N4O3Sc11881019(11918)2624(30)173325282723(1632226435722)29(25)20121421(312)151320h315H1617H212H3(H2630)
MFCD03460495
ZINC000002212264
ZINC02212264
ZINC2212264

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Available files

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