Vitas-M small molecule compound
diethyl 5-{[(2E)-3-(3-bromo-4-methoxyphenyl)prop-2-enoyl]amino}-3-methylthiophene-2,4-dicarboxylate
Catalog ID
STK969916
SMILES CCOC(=O)c1c(NC(=O)/C=C/c2ccc(c(c2)Br)OC)sc(c1C)C(=O)OCC
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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 C21H22BrNO6S MW 496.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22BrNO6S/c1-5-28-20(25)17-12(3)18(21(26)29-6-2)30-19(17)23-16(24)10-8-13-7-9-15(27-4)14(22)11-13/h7-11H,5-6H2,1-4H3,(H,23,24)/b10-8+InChIKey
WFQSSDUXEZVCJH-CSKARUKUSA-NSynonyms
307505-48-2(E)diethyl5(3(3bromo4methoxyphenyl)acrylamido)3methylthiophene24dicarboxylate
307505482
CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=O)C=CC2=CC(=C(C=C2)OC)Br
CCOC(=O)c1c(NC(=O)C=Cc2ccc(c(c2)Br)OC)sc(c1C)C(=O)OCC
diethyl5(((2E)3(3bromo4methoxyphenyl)prop2enoyl)amino)3methylthiophene24dicarboxylate
diethyl5(((E)3(3bromo4methoxyphenyl)prop2enoyl)amino)3methylthiophene24dicarboxylate
ETHYL2((2E)3(3BROMO4METHOXYPHENYL)PROP2ENOYLAMINO)5(ETHOXYCARBONYL)4METHYLTHIOPHENE3CARBOXYLATE
InChI=1SC21H22BrNO6Sc152820(25)1712(3)18(21(26)2962)3019(17)2316(24)108137915(274)14(22)1113h711H56H214H3(H2324)b108+
MFCD01530637
ZINC000000943626
ZINC00943626
ZINC943626
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