Vitas-M small molecule compound
2-{[4-cyclohexyl-5-(2,4-dichlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(4-fluorophenyl)ethanone
Catalog ID
STK663949
SMILES Fc1ccc(cc1)C(=O)CSc1nnc(n1C1CCCCC1)c1ccc(cc1Cl)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 C22H20Cl2FN3OS MW 464.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20Cl2FN3OS/c23-15-8-11-18(19(24)12-15)21-26-27-22(28(21)17-4-2-1-3-5-17)30-13-20(29)14-6-9-16(25)10-7-14/h6-12,17H,1-5,13H2InChIKey
JMUWOFPSHKIEEW-UHFFFAOYSA-NSynonyms
2((4CYCLOHEXYL5(24DICHLOROPHENYL)124TRIAZOL3YL)SULFANYL)1(4FLUOROPHENYL)ETHANONE
2((4cyclohexyl5(24dichlorophenyl)4H124triazol3yl)sulfanyl)1(4fluorophenyl)ethanone
C1CCC(CC1)N2C(=NN=C2SCC(=O)C3=CC=C(C=C3)F)C4=C(C=C(C=C4)Cl)Cl
InChI=1SC22H20Cl2FN3OSc231581118(19(24)1215)21262722(28(21)174213517)301320(29)146916(25)10714h61217H1513H2
MFCD03768477
ZINC000008869553
ZINC08869553
ZINC8869553
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