Vitas-M small molecule compound

2-[(4,5-dimethyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N-(4-fluorophenyl)acetamide

Catalog ID
STK400841
SMILES O=C(Nc1ccc(cc1)F)CSc1nnc(n1C)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 C12H13FN4OS MW 280.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H13FN4OS/c1-8-15-16-12(17(8)2)19-7-11(18)14-10-5-3-9(13)4-6-10/h3-6H,7H2,1-2H3,(H,14,18)
InChIKey
YIUDWKNVWKBCHN-UHFFFAOYSA-N
Synonyms
588712-08-7
2((45DIMETHYL124TRIAZOL3YL)SULFANYL)N(4FLUOROPHENYL)ACETAMIDE
2((45dimethyl4H124triazol3yl)sulfanyl)N(4fluorophenyl)acetamide
2(45DIMETHYL(124TRIAZOL3YLTHIO))N(4FLUOROPHENYL)ACETAMIDE
588712087
CC1=NN=C(N1C)SCC(=O)NC2=CC=C(C=C2)F
InChI=1SC12H13FN4OSc18151612(17(8)2)19711(18)1410539(13)4610h36H7H212H3(H1418)
MFCD03945030
ZINC000006651051
ZINC06651051
ZINC6651051

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Available files

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