Vitas-M small molecule compound
2-bromo-6-methoxy-4-(morpholin-4-ylcarbonothioyl)phenyl (4-fluorophenyl)acetate
Catalog ID
STL384023
SMILES COc1cc(cc(c1OC(=O)Cc1ccc(cc1)F)Br)C(=S)N1CCOCC1
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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 C20H19BrFNO4S MW 468.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19BrFNO4S/c1-25-17-12-14(20(28)23-6-8-26-9-7-23)11-16(21)19(17)27-18(24)10-13-2-4-15(22)5-3-13/h2-5,11-12H,6-10H2,1H3InChIKey
VKYHSANOHAALQY-UHFFFAOYSA-NSynonyms
(2bromo6methoxy4(morpholine4carbothioyl)phenyl)2(4fluorophenyl)acetate
2bromo6methoxy4(morpholin4ylcarbonothioyl)phenyl(4fluorophenyl)acetate
COC1=C(C(=CC(=C1)C(=S)N2CCOCC2)Br)OC(=O)CC3=CC=C(C=C3)F
InChI=1SC20H19BrFNO4Sc125171214(20(28)2368269723)1116(21)19(17)2718(24)10132415(22)5313h251112H610H21H3
MFCD03271479
ZINC000098087155
ZINC98087155
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