Vitas-M small molecule compound
1-{2-[(7Z)-7-(4-fluorobenzylidene)-3-(4-fluorophenyl)-3,3a,4,5,6,7-hexahydro-2H-indazol-2-yl]-4-methyl-1,3-thiazol-5-yl}ethanone
Catalog ID
STK993732
SMILES Fc1ccc(cc1)/C=C\1/CCCC2C1=NN(C2c1ccc(cc1)F)c1nc(c(s1)C(=O)C)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 C26H23F2N3OS MW 463.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H23F2N3OS/c1-15-25(16(2)32)33-26(29-15)31-24(18-8-12-21(28)13-9-18)22-5-3-4-19(23(22)30-31)14-17-6-10-20(27)11-7-17/h6-14,22,24H,3-5H2,1-2H3/b19-14-InChIKey
XFNWMGBBUYGBNP-RGEXLXHISA-NSynonyms
1(2((7Z)3(4fluorophenyl)7((4fluorophenyl)methylidene)3a456tetrahydro3Hindazol2yl)4methyl13thiazol5yl)ethanone
1(2((7Z)7(4fluorobenzylidene)3(4fluorophenyl)33a4567hexahydro2Hindazol2yl)4methyl13thiazol5yl)ethanone
CC1=C(SC(=N1)N2C(C3CCCC(=CC4=CC=C(C=C4)F)C3=N2)C5=CC=C(C=C5)F)C(=O)C
Fc1ccc(cc1)C=C1CCCC2C1=NN(C2c1ccc(cc1)F)c1nc(c(s1)C(=O)C)C
InChI=1SC26H23F2N3OSc11525(16(2)32)3326(2915)3124(1881221(28)13918)2253419(23(22)3031)141761020(27)11717h6142224H35H212H3b1914
MFCD18184997
ZINC000033691469
ZINC000051330462
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