Vitas-M small molecule compound
1-[(7E)-7-(4-bromobenzylidene)-3-(4-bromophenyl)-3,3a,4,5,6,7-hexahydro-2H-indazol-2-yl]-2-(2-fluorophenoxy)ethanone
Catalog ID
STK889208
SMILES Brc1ccc(cc1)C1N(N=C2C1CCC/C/2=C\c1ccc(cc1)Br)C(=O)COc1ccccc1F
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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 C28H23Br2FN2O2 MW 598.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H23Br2FN2O2/c29-21-12-8-18(9-13-21)16-20-4-3-5-23-27(20)32-33(28(23)19-10-14-22(30)15-11-19)26(34)17-35-25-7-2-1-6-24(25)31/h1-2,6-16,23,28H,3-5,17H2/b20-16+InChIKey
ZLAZPTARQNWMFO-CAPFRKAQSA-NSynonyms
1((7E)3(4BROMOPHENYL)7((4BROMOPHENYL)METHYLIDENE)3A456TETRAHYDRO3HINDAZOL2YL)2(2FLUOROPHENOXY)ETHANONE
1((7E)7(4bromobenzylidene)3(4bromophenyl)33a4567hexahydro2Hindazol2yl)2(2fluorophenoxy)ethanone
Brc1ccc(cc1)C1N(N=C2C1CCCC2=Cc1ccc(cc1)Br)C(=O)COc1ccccc1F
C1CC2C(N(N=C2C(=CC3=CC=C(C=C3)Br)C1)C(=O)COC4=CC=CC=C4F)C5=CC=C(C=C5)Br
InChI=1SC28H23Br2FN2O2c292112818(91321)16204352327(20)3233(28(23)19101422(30)151119)26(34)173525721624(25)31h126162328H3517H2b2016+
MFCD02703781
ZINC000096022594
ZINC000097965202
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