Vitas-M small molecule compound
N-benzyl-2-{(1E)-5-fluoro-2-methyl-1-[4-(methylsulfinyl)benzylidene]-1H-inden-3-yl}acetamide
Catalog ID
STK595765
SMILES O=C(CC1=C(C)/C(=C\c2ccc(cc2)S(=O)C)/c2c1cc(F)cc2)NCc1ccccc1
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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 C27H24FNO2S MW 445.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H24FNO2S/c1-18-24(14-19-8-11-22(12-9-19)32(2)31)23-13-10-21(28)15-26(23)25(18)16-27(30)29-17-20-6-4-3-5-7-20/h3-15H,16-17H2,1-2H3,(H,29,30)/b24-14+InChIKey
WKDGGHQUVMNSDK-ZVHZXABRSA-NSynonyms
(E)Nbenzyl2(5fluoro2methyl1(4(methylsulfinyl)benzylidene)1Hinden3yl)acetamidehydrochloride
CC1=C(C2=C(C1=CC3=CC=C(C=C3)S(=O)C)C=CC(=C2)F)CC(=O)NCC4=CC=CC=C4
InChI=1SC27H24FNO2Sc11824(141981122(12919)32(2)31)23131021(28)1526(23)25(18)1627(30)2917206435720h315H1617H212H3(H2930)b2414+
MFCD07639624
Nbenzyl2((1E)5fluoro2methyl1(4(methylsulfinyl)benzylidene)1Hinden3yl)acetamide
Nbenzyl2((3E)6fluoro2methyl3((4methylsulfinylphenyl)methylidene)inden1yl)acetamide
O=C(CC1=C(C)C(=Cc2ccc(cc2)S(=O)C)c2c1cc(F)cc2)NCc1ccccc1
O=C(CC1=C(C)C(=Cc2ccc(cc2)S(=O)C)c2c1cc(F)cc2)NCc1ccccc1Cl
ZINC000101377248
ZINC000101377251
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