Vitas-M small molecule compound
2-{(1E)-5-fluoro-2-methyl-1-[4-(methylsulfinyl)benzylidene]-1H-inden-3-yl}-N-(3-methoxypropyl)acetamide
Catalog ID
STK717317
SMILES COCCCNC(=O)CC1=C(C)/C(=C\c2ccc(cc2)S(=O)C)/c2c1cc(F)cc2
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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 C24H26FNO3S MW 427.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H26FNO3S/c1-16-21(13-17-5-8-19(9-6-17)30(3)28)20-10-7-18(25)14-23(20)22(16)15-24(27)26-11-4-12-29-2/h5-10,13-14H,4,11-12,15H2,1-3H3,(H,26,27)/b21-13+InChIKey
LNMCXKHWVCSUJG-FYJGNVAPSA-NSynonyms
956617-64-4(E)2(5fluoro2methyl1(4(methylsulfinyl)benzylidene)1Hinden3yl)N(3methoxypropyl)acetamide
2((1E)5fluoro2methyl1(4(methylsulfinyl)benzylidene)1Hinden3yl)N(3methoxypropyl)acetamide
2((3E)6fluoro2methyl3((4methylsulfinylphenyl)methylidene)inden1yl)N(3methoxypropyl)acetamide
956617644
CC1=C(C2=C(C1=CC3=CC=C(C=C3)S(=O)C)C=CC(=C2)F)CC(=O)NCCCOC
COCCCNC(=O)CC1=C(C)C(=Cc2ccc(cc2)S(=O)C)c2c1cc(F)cc2
InChI=1SC24H26FNO3Sc11621(13175819(9617)30(3)28)2010718(25)1423(20)22(16)1524(27)2611412292h5101314H4111215H213H3(H2627)b2113+
MFCD08746918
ZINC000101448995
ZINC000101448998
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