[6-(4-fluoranyl-2-methoxy-phenyl)-2,2,4-trimethyl-3-oxidanylidene-1H-quinoxalin-5-yl]methyl 5-bromanylthiophene-2-carboxylate

Systemtic Name: [6-(4-fluoranyl-2-methoxy-phenyl)-2,2,4-trimethyl-3-oxidanylidene-1H-quinoxalin-5-yl]methyl 5-bromanylthiophene-2-carboxylate Openeye Name: [6-(4-fluoro-2-methoxy-phenyl)-2,2,4-trimethyl-3-oxo-1H-quinoxalin-5-yl]methyl 5-bromothiophene-2-carboxylate CAS Name: 5-bromo-2-thiophenecarboxylic acid [6-(4-fluoro-2-methoxyphenyl)-2,2,4-trimethyl-3-oxo-1H-quinoxalin-5-yl]methyl ester IUPAC Name: [6-(4-fluoro-2-methoxyphenyl)-2,2,4-trimethyl-3-oxo-1H-quinoxalin-5-yl]methyl 5-bromothiophene-2-carboxylate Traditional Name: 5-bromothiophene-2-carboxylic acid [6-(4-fluoro-2-methoxy-phenyl)-3-keto-2,2,4-trimethyl-1H-quinoxalin-5-yl]methyl ester Formula: C24H22BrFN2O4S MolecularWeight: 533.409883

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)N(C2=C(N1)C=CC(=C2COC(=O)C3=CC=C(S3)Br)C4=C(C=C(C=C4)F)OC)C)C

Isomeric SMILES

CC1(C(=O)N(C2=C(N1)C=CC(=C2COC(=O)C3=CC=C(S3)Br)C4=C(C=C(C=C4)F)OC)C)C

InChI

InChI=1S/C24H22BrFN2O4S/c1-24(2)23(30)28(3)21-16(12-32-22(29)19-9-10-20(25)33-19)14(7-8-17(21)27-24)15-6-5-13(26)11-18(15)31-4/h5-11,27H,12H2,1-4H3