Vitas-M small molecule compound
2-{[3-cyano-6-{4-[(4-fluorobenzyl)oxy]phenyl}-4-(trifluoromethyl)pyridin-2-yl]sulfanyl}-N-(4-ethoxyphenyl)acetamide
Catalog ID
STK816288
SMILES CCOc1ccc(cc1)NC(=O)CSc1nc(cc(c1C#N)C(F)(F)F)c1ccc(cc1)OCc1ccc(cc1)F
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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 C30H23F4N3O3S MW 581.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H23F4N3O3S/c1-2-39-23-13-9-22(10-14-23)36-28(38)18-41-29-25(16-35)26(30(32,33)34)15-27(37-29)20-5-11-24(12-6-20)40-17-19-3-7-21(31)8-4-19/h3-15H,2,17-18H2,1H3,(H,36,38)InChIKey
DJSFOXDTCJAGGA-UHFFFAOYSA-NSynonyms
2((3cyano6(4((4fluorobenzyl)oxy)phenyl)4(trifluoromethyl)pyridin2yl)sulfanyl)N(4ethoxyphenyl)acetamide
2(3CYANO6(4((4FLUOROPHENYL)METHOXY)PHENYL)4(TRIFLUOROMETHYL)PYRIDIN2YL)SULFANYLN(4ETHOXYPHENYL)ACETAMIDE
CCOC1=CC=C(C=C1)NC(=O)CSC2=C(C(=CC(=N2)C3=CC=C(C=C3)OCC4=CC=C(C=C4)F)C(F)(F)F)C#N
InChI=1SC30H23F4N3O3Sc12392313922(101423)3628(38)18412925(1635)26(30(3233)34)1527(3729)2051124(12620)4017193721(31)8419h315H21718H21H3(H3638)
MFCD04555574
ZINC000098047542
ZINC98047542
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