Vitas-M small molecule compound
2-{(1E)-5-fluoro-2-methyl-1-[4-(methylsulfinyl)benzylidene]-1H-inden-3-yl}-N-(pyridin-3-ylmethyl)acetamide
Catalog ID
STK571593
SMILES O=C(CC1=C(C)/C(=C\c2ccc(cc2)S(=O)C)/c2c1cc(F)cc2)NCc1cccnc1
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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 C26H23FN2O2S MW 446.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H23FN2O2S/c1-17-23(12-18-5-8-21(9-6-18)32(2)31)22-10-7-20(27)13-25(22)24(17)14-26(30)29-16-19-4-3-11-28-15-19/h3-13,15H,14,16H2,1-2H3,(H,29,30)/b23-12+InChIKey
ZJETYOGXSUWTAS-FSJBWODESA-NSynonyms
1010867-02-3(E)2(5fluoro2methyl1(4(methylsulfinyl)benzylidene)1Hinden3yl)N(pyridin3ylmethyl)acetamide
1010867023
2((1E)5fluoro2methyl1(4(methylsulfinyl)benzylidene)1Hinden3yl)N(pyridin3ylmethyl)acetamide
2((3E)6fluoro2methyl3((4methylsulfinylphenyl)methylidene)inden1yl)N(pyridin3ylmethyl)acetamide
CC1=C(C2=C(C1=CC3=CC=C(C=C3)S(=O)C)C=CC(=C2)F)CC(=O)NCC4=CN=CC=C4
InChI=1SC26H23FN2O2Sc11723(12185821(9618)32(2)31)2210720(27)1325(22)24(17)1426(30)2916194311281519h31315H1416H212H3(H2930)b2312+
MFCD07639331
O=C(CC1=C(C)C(=Cc2ccc(cc2)S(=O)C)c2c1cc(F)cc2)NCc1cccnc1
ZINC000101375761
ZINC000101375765
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