ethyl 4-(4-bromophenyl)-2-[(3,5-dimethoxyphenyl)carbonylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 4-(4-bromophenyl)-2-[(3,5-dimethoxyphenyl)carbonylamino]thiophene-3-carboxylate Openeye Name: ethyl 4-(4-bromophenyl)-2-[(3,5-dimethoxybenzoyl)amino]thiophene-3-carboxylate CAS Name: 4-(4-bromophenyl)-2-[[(3,5-dimethoxyphenyl)-oxomethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-bromophenyl)-2-[(3,5-dimethoxybenzoyl)amino]thiophene-3-carboxylate Traditional Name: 4-(4-bromophenyl)-2-[(3,5-dimethoxybenzoyl)amino]thiophene-3-carboxylic acid ethyl ester Formula: C22H20BrNO5S MolecularWeight: 490.3669

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)Br)NC(=O)C3=CC(=CC(=C3)OC)OC

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)Br)NC(=O)C3=CC(=CC(=C3)OC)OC

InChI

InChI=1S/C22H20BrNO5S/c1-4-29-22(26)19-18(13-5-7-15(23)8-6-13)12-30-21(19)24-20(25)14-9-16(27-2)11-17(10-14)28-3/h5-12H,4H2,1-3H3,(H,24,25)