Vitas-M small molecule compound
ethyl (5Z)-5-[3,5-dibromo-4-(prop-2-en-1-yloxy)benzylidene]-4-oxo-2-[(phenylcarbonyl)amino]-4,5-dihydrothiophene-3-carboxylate
Catalog ID
STL380510
SMILES C=CCOc1c(Br)cc(cc1Br)/C=C/1\SC(=C(C1=O)C(=O)OCC)NC(=O)c1ccccc1
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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 C24H19Br2NO5S MW 593.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H19Br2NO5S/c1-3-10-32-21-16(25)11-14(12-17(21)26)13-18-20(28)19(24(30)31-4-2)23(33-18)27-22(29)15-8-6-5-7-9-15/h3,5-9,11-13H,1,4,10H2,2H3,(H,27,29)/b18-13-InChIKey
HCTWCDSLXSHFJA-AQTBWJFISA-NSynonyms
C=CCOc1c(Br)cc(cc1Br)C=C1SC(=C(C1=O)C(=O)OCC)NC(=O)c1ccccc1
CCOC(=O)C1=C(SC(=CC2=CC(=C(C(=C2)Br)OCC=C)Br)C1=O)NC(=O)C3=CC=CC=C3
ETHYL(5Z)2BENZAMIDO5((35DIBROMO4PROP2ENOXYPHENYL)METHYLIDENE)4OXOTHIOPHENE3CARBOXYLATE
ethyl(5Z)5(35dibromo4(prop2en1yloxy)benzylidene)4oxo2((phenylcarbonyl)amino)45dihydrothiophene3carboxylate
ETHYL5(4(ALLYLOXY)35DIBROMOBENZYLIDENE)2(BENZOYLAMINO)4OXO45DIHYDRO3THIOPHENECARBOXYLATE
InChI=1SC24H19Br2NO5Sc1310322116(25)1114(1217(21)26)131820(28)19(24(30)3142)23(3318)2722(29)158657915h3591113H1410H22H3(H2729)b1813
MFCD03783976
ZINC000008396227
ZINC08396227
ZINC8396227
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