Vitas-M small molecule compound
N-(1H-benzimidazol-2-yl)-2-{(1E)-5-fluoro-2-methyl-1-[4-(methylsulfinyl)benzylidene]-1H-inden-3-yl}acetamide
Catalog ID
STK622651
SMILES Fc1ccc2c(c1)C(=C(/C/2=C\c1ccc(cc1)S(=O)C)C)CC(=O)Nc1nc2c([nH]1)cccc2
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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 C27H22FN3O2S MW 471.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H22FN3O2S/c1-16-21(13-17-7-10-19(11-8-17)34(2)33)20-12-9-18(28)14-23(20)22(16)15-26(32)31-27-29-24-5-3-4-6-25(24)30-27/h3-14H,15H2,1-2H3,(H2,29,30,31,32)/b21-13+InChIKey
WDVHAZDJFJYPIZ-FYJGNVAPSA-NSynonyms
956380-96-4(E)N(1Hbenzo(d)imidazol2yl)2(5fluoro2methyl1(4(methylsulfinyl)benzylidene)1Hinden3yl)acetamide
956380964
CC1=C(C2=C(C1=CC3=CC=C(C=C3)S(=O)C)C=CC(=C2)F)CC(=O)NC4=NC5=CC=CC=C5N4
Fc1ccc2c(c1)C(=C(C2=Cc1ccc(cc1)S(=O)C)C)CC(=O)Nc1nc2c((nH)1)cccc2
InChI=1SC27H22FN3O2Sc11621(131771019(11817)34(2)33)2012918(28)1423(20)22(16)1526(32)31272924534625(24)3027h314H15H212H3(H229303132)b2113+
MFCD09796002
N(1Hbenzimidazol2yl)2((1E)5fluoro2methyl1(4(methylsulfinyl)benzylidene)1Hinden3yl)acetamide
N(1Hbenzimidazol2yl)2((3E)6fluoro2methyl3((4methylsulfinylphenyl)methylidene)inden1yl)acetamide
ZINC000101467754
ZINC000101467758
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