Vitas-M small molecule compound
ethyl 5-carbamoyl-2-{[(2E)-3-(2-chloro-6-fluorophenyl)prop-2-enoyl]amino}-4-methylthiophene-3-carboxylate
Catalog ID
STK440691
SMILES CCOC(=O)c1c(NC(=O)/C=C/c2c(F)cccc2Cl)sc(c1C)C(=O)N
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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 C18H16ClFN2O4S MW 410.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16ClFN2O4S/c1-3-26-18(25)14-9(2)15(16(21)24)27-17(14)22-13(23)8-7-10-11(19)5-4-6-12(10)20/h4-8H,3H2,1-2H3,(H2,21,24)(H,22,23)/b8-7+InChIKey
CYLOUXSUHVXTJU-BQYQJAHWSA-NSynonyms
CCOC(=O)C1=C(SC(=C1C)C(=O)N)NC(=O)C=CC2=C(C=CC=C2Cl)F
CCOC(=O)c1c(NC(=O)C=Cc2c(F)cccc2Cl)sc(c1C)C(=O)N
ETHYL2((2E)3(2CHLORO6FLUOROPHENYL)PROP2ENOYLAMINO)5CARBAMOYL4METHYLTHIOPHENE3CARBOXYLATE
ethyl5carbamoyl2(((2E)3(2chloro6fluorophenyl)prop2enoyl)amino)4methylthiophene3carboxylate
ETHYL5CARBAMOYL2(((E)3(2CHLORO6FLUOROPHENYL)PROP2ENOYL)AMINO)4METHYLTHIOPHENE3CARBOXYLATE
InChI=1SC18H16ClFN2O4Sc132618(25)149(2)15(16(21)24)2717(14)2213(23)871011(19)54612(10)20h48H3H212H3(H22124)(H2223)b87+
MFCD03384214
ZINC000001117153
ZINC01117153
ZINC1117153
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