Vitas-M small molecule compound

2-{[5-(2-methoxyphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,4,6-trimethylphenyl)acetamide

Catalog ID
STK795850
SMILES COc1ccccc1c1nnc(n1c1ccccc1)SCC(=O)Nc1c(C)cc(cc1C)C

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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 C26H26N4O2S MW 458.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26N4O2S/c1-17-14-18(2)24(19(3)15-17)27-23(31)16-33-26-29-28-25(21-12-8-9-13-22(21)32-4)30(26)20-10-6-5-7-11-20/h5-15H,16H2,1-4H3,(H,27,31)
InChIKey
FRTZWHHPVVGAAY-UHFFFAOYSA-N
Synonyms
896843-76-8
2((5(2METHOXYPHENYL)4PHENYL124TRIAZOL3YL)SULFANYL)N(246TRIMETHYLPHENYL)ACETAMIDE
2((5(2methoxyphenyl)4phenyl4H124triazol3yl)sulfanyl)N(246trimethylphenyl)acetamide
2(5(2METHOXYPHENYL)4PHENYL(124TRIAZOL3YLTHIO))N(246TRIMETHYLPHENYL)ACETAMIDE
896843768
CC1=CC(=C(C(=C1)C)NC(=O)CSC2=NN=C(N2C3=CC=CC=C3)C4=CC=CC=C4OC)C
InChI=1SC26H26N4O2Sc1171418(2)24(19(3)1517)2723(31)163326292825(2112891322(21)324)30(26)20106571120h515H16H214H3(H2731)
MFCD05539550
Nmesityl2((5(2methoxyphenyl)4phenyl4H124triazol3yl)thio)acetamide
ZINC000002230795
ZINC02230795
ZINC2230795

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Available files

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