Vitas-M small molecule compound
ethyl 2-{[(2-bromo-4-methylphenoxy)acetyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK179355
SMILES CCOC(=O)c1c(NC(=O)COc2ccc(cc2Br)C)sc2c1CCCC2
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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 C20H22BrNO4S MW 452.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22BrNO4S/c1-3-25-20(24)18-13-6-4-5-7-16(13)27-19(18)22-17(23)11-26-15-9-8-12(2)10-14(15)21/h8-10H,3-7,11H2,1-2H3,(H,22,23)InChIKey
PXTJBEQZOGLUGY-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)COC3=C(C=C(C=C3)C)Br
ethyl2(((2bromo4methylphenoxy)acetyl)amino)4567tetrahydro1benzothiophene3carboxylate
ethyl2((2(2bromo4methylphenoxy)acetyl)amino)4567tetrahydro1benzothiophene3carboxylate
InChI=1SC20H22BrNO4Sc132520(24)1813645716(13)2719(18)2217(23)1126159812(2)1014(15)21h810H3711H212H3(H2223)
MFCD00495519
ZINC000000633840
ZINC00633840
ZINC633840
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