Vitas-M small molecule compound
{3-bromo-5-ethoxy-4-[(2-fluorobenzyl)oxy]phenyl}(piperidin-1-yl)methanethione
Catalog ID
STL376407
SMILES CCOc1cc(cc(c1OCc1ccccc1F)Br)C(=S)N1CCCCC1
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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 C21H23BrFNO2S MW 452.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23BrFNO2S/c1-2-25-19-13-16(21(27)24-10-6-3-7-11-24)12-17(22)20(19)26-14-15-8-4-5-9-18(15)23/h4-5,8-9,12-13H,2-3,6-7,10-11,14H2,1H3InChIKey
WOESHLMTKNRXJP-UHFFFAOYSA-NSynonyms
(3bromo5ethoxy4((2fluorobenzyl)oxy)phenyl)(piperidin1yl)methanethione
(3BROMO5ETHOXY4((2FLUOROPHENYL)METHOXY)PHENYL)PIPERIDIN1YLMETHANETHIONE
CCOC1=C(C(=CC(=C1)C(=S)N2CCCCC2)Br)OCC3=CC=CC=C3F
InChI=1SC21H23BrFNO2Sc1225191316(21(27)24106371124)1217(22)20(19)261415845918(15)23h45891213H2367101114H21H3
MFCD05998265
ZINC000001072757
ZINC01072757
ZINC1072757
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