Vitas-M small molecule compound

N-(3,5-dichlorophenyl)-2-{[5-(2-fluorophenyl)-4-(furan-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide

Catalog ID
STK595311
SMILES O=C(Nc1cc(Cl)cc(c1)Cl)CSc1nnc(n1Cc1ccco1)c1ccccc1F

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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 C21H15Cl2FN4O2S MW 477.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H15Cl2FN4O2S/c22-13-8-14(23)10-15(9-13)25-19(29)12-31-21-27-26-20(17-5-1-2-6-18(17)24)28(21)11-16-4-3-7-30-16/h1-10H,11-12H2,(H,25,29)
InChIKey
BCFTZPBAVXPLAC-UHFFFAOYSA-N
Synonyms
849033-72-3
849033723
C1=CC=C(C(=C1)C2=NN=C(N2CC3=CC=CO3)SCC(=O)NC4=CC(=CC(=C4)Cl)Cl)F
InChI=1SC21H15Cl2FN4O2Sc2213814(23)1015(913)2519(29)123121272620(17512618(17)24)28(21)11164373016h110H1112H2(H2529)
MFCD05682172
N(35DICHLOROPHENYL)2((5(2FLUOROPHENYL)4(FURAN2YLMETHYL)124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(35dichlorophenyl)2((5(2fluorophenyl)4(furan2ylmethyl)4H124triazol3yl)sulfanyl)acetamide
N(35dichlorophenyl)2((5(2fluorophenyl)4(furan2ylmethyl)4H124triazol3yl)thio)acetamide
N(35DICHLOROPHENYL)2(5(2FLUOROPHENYL)4(2FURYLMETHYL)(124TRIAZOL3YLTHIO))ACETAMIDE
ZINC000013803603
ZINC13803603

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Available files

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