methyl 4-(4-bromophenyl)-2-(2-phenoxyethanoylamino)thiophene-3-carboxylate

Systemtic Name: methyl 4-(4-bromophenyl)-2-(2-phenoxyethanoylamino)thiophene-3-carboxylate Openeye Name: methyl 4-(4-bromophenyl)-2-[(2-phenoxyacetyl)amino]thiophene-3-carboxylate CAS Name: 4-(4-bromophenyl)-2-[(1-oxo-2-phenoxyethyl)amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-(4-bromophenyl)-2-[(2-phenoxyacetyl)amino]thiophene-3-carboxylate Traditional Name: 4-(4-bromophenyl)-2-[(2-phenoxyacetyl)amino]thiophene-3-carboxylic acid methyl ester Formula: C20H16BrNO4S MolecularWeight: 446.31434

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SC=C1C2=CC=C(C=C2)Br)NC(=O)COC3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=C(SC=C1C2=CC=C(C=C2)Br)NC(=O)COC3=CC=CC=C3

InChI

InChI=1S/C20H16BrNO4S/c1-25-20(24)18-16(13-7-9-14(21)10-8-13)12-27-19(18)22-17(23)11-26-15-5-3-2-4-6-15/h2-10,12H,11H2,1H3,(H,22,23)