Vitas-M small molecule compound

2-({5-[(4-chlorophenoxy)methyl]-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl}sulfanyl)-1-(4-fluorophenyl)ethanone

Catalog ID
STL056719
SMILES COc1ccc(cc1)n1c(SCC(=O)c2ccc(cc2)F)nnc1COc1ccc(cc1)Cl

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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 C24H19ClFN3O3S MW 483.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H19ClFN3O3S/c1-31-20-12-8-19(9-13-20)29-23(14-32-21-10-4-17(25)5-11-21)27-28-24(29)33-15-22(30)16-2-6-18(26)7-3-16/h2-13H,14-15H2,1H3
InChIKey
CDDNOUFTWHBLIV-UHFFFAOYSA-N
Synonyms
849031-82-9
2((5((4CHLOROPHENOXY)METHYL)4(4METHOXYPHENYL)124TRIAZOL3YL)SULFANYL)1(4FLUOROPHENYL)ETHANONE
2((5((4chlorophenoxy)methyl)4(4methoxyphenyl)4H124triazol3yl)sulfanyl)1(4fluorophenyl)ethanone
2((5((4chlorophenoxy)methyl)4(4methoxyphenyl)4H124triazol3yl)thio)1(4fluorophenyl)ethanone
2((5(4CHLOROPHENOXYMETHYL)4(4METHOXYPHENYL)4H124TRIAZOL3YL)SULFANYL)1(4FLUOROPHENYL)ETHAN1ONE
2(5((4CHLOROPHENOXY)METHYL)4(4METHOXYPHENYL)(124TRIAZOL3YLTHIO))1(4FLUOROPHENYL)ETHAN1ONE
849031829
COC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)C3=CC=C(C=C3)F)COC4=CC=C(C=C4)Cl
InChI=1SC24H19ClFN3O3Sc1312012819(91320)2923(14322110417(25)51121)272824(29)331522(30)162618(26)7316h213H1415H21H3
MFCD05681986
ZINC000002454387
ZINC02454387
ZINC2454387

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Available files

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