Vitas-M small molecule compound

2-{[4-ethyl-5-(1-ethyl-1H-pyrazol-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,4,5-trichlorophenyl)acetamide

Catalog ID
STK434993
SMILES CCn1c(SCC(=O)Nc2cc(Cl)c(cc2Cl)Cl)nnc1c1cnn(c1)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 C17H17Cl3N6OS MW 459.79 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17Cl3N6OS/c1-3-25-8-10(7-21-25)16-23-24-17(26(16)4-2)28-9-15(27)22-14-6-12(19)11(18)5-13(14)20/h5-8H,3-4,9H2,1-2H3,(H,22,27)
InChIKey
RWHIQLWRQCUBJS-UHFFFAOYSA-N
Synonyms

2((4ethyl5(1ethyl1Hpyrazol4yl)4H124triazol3yl)sulfanyl)N(245trichlorophenyl)acetamide
2((4ETHYL5(1ETHYLPYRAZOL4YL)124TRIAZOL3YL)SULFANYL)N(245TRICHLOROPHENYL)ACETAMIDE
2(4ETHYL5(1ETHYLPYRAZOL4YL)(124TRIAZOL3YLTHIO))N(245TRICHLOROPHENYL)ACETAMIDE
CCN1C=C(C=N1)C2=NN=C(N2CC)SCC(=O)NC3=CC(=C(C=C3Cl)Cl)Cl
InChI=1SC17H17Cl3N6OSc1325810(72125)16232417(26(16)42)28915(27)2214612(19)11(18)513(14)20h58H349H212H3(H2227)
MFCD03943140
ZINC000020215387
ZINC20215387

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Available files

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