Vitas-M small molecule compound

2-[(4-amino-5-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N-[4-chloro-3-(trifluoromethyl)phenyl]acetamide

Catalog ID
STK684305
SMILES O=C(Nc1ccc(c(c1)C(F)(F)F)Cl)CSc1nnc(n1N)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 C12H11ClF3N5OS MW 365.77 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H11ClF3N5OS/c1-6-19-20-11(21(6)17)23-5-10(22)18-7-2-3-9(13)8(4-7)12(14,15)16/h2-4H,5,17H2,1H3,(H,18,22)
InChIKey
NGZXDMOGXKVBOL-UHFFFAOYSA-N
Synonyms

2((4AMINO5METHYL124TRIAZOL3YL)SULFANYL)N(4CHLORO3(TRIFLUOROMETHYL)PHENYL)ACETAMIDE
2((4amino5methyl4H124triazol3yl)sulfanyl)N(4chloro3(trifluoromethyl)phenyl)acetamide
CC1=NN=C(N1N)SCC(=O)NC2=CC(=C(C=C2)Cl)C(F)(F)F
InChI=1SC12H11ClF3N5OSc16192011(21(6)17)23510(22)187239(13)8(47)12(1415)16h24H517H21H3(H1822)
MFCD04556663
ZINC000001424849
ZINC01424849
ZINC1424849

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Available files

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