Vitas-M small molecule compound

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

Catalog ID
STK060655
SMILES Cc1ccc(cc1)n1c(SCC(=O)Nc2c(C)cc(cc2C)C)nnc1c1ccncc1

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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 C25H25N5OS MW 443.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25N5OS/c1-16-5-7-21(8-6-16)30-24(20-9-11-26-12-10-20)28-29-25(30)32-15-22(31)27-23-18(3)13-17(2)14-19(23)4/h5-14H,15H2,1-4H3,(H,27,31)
InChIKey
MKMKFWHDBUZOLN-UHFFFAOYSA-N
Synonyms
338425-88-0
2((4(4METHYLPHENYL)5(PYRIDIN4YL)4H124TRIAZOL3YL)SULFANYL)N(246TRIMETHYLPHENYL)ACETAMIDE
2((4(4METHYLPHENYL)5PYRIDIN4YL124TRIAZOL3YL)SULFANYL)N(246TRIMETHYLPHENYL)ACETAMIDE
2(4(4METHYLPHENYL)5(4PYRIDYL)(124TRIAZOL3YLTHIO))N(246TRIMETHYLPHENYL)ACETAMIDE
338425880
CC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NC3=C(C=C(C=C3C)C)C)C4=CC=NC=C4
Cc1ccc(cc1)n1c(SCC(=O)Nc2c(C)cc(cc2C)C)nnc1c1ccncc1
InChI=1SC25H25N5OSc1165721(8616)3024(2091126121020)282925(30)321522(31)272318(3)1317(2)1419(23)4h514H15H214H3(H2731)
MFCD02739872
NMESITYL2((4(4METHYLPHENYL)5(4PYRIDINYL)4H124TRIAZOL3YL)SULFANYL)ACETAMIDE
Nmesityl2((5(pyridin4yl)4(ptolyl)4H124triazol3yl)thio)acetamide
STK060655
ZINC000000897287
ZINC00897287
ZINC897287

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Available files

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