methyl 4-(3-bromophenyl)-2-[(4-ethoxyphenyl)carbonylamino]thiophene-3-carboxylate

Systemtic Name: methyl 4-(3-bromophenyl)-2-[(4-ethoxyphenyl)carbonylamino]thiophene-3-carboxylate Openeye Name: methyl 4-(3-bromophenyl)-2-[(4-ethoxybenzoyl)amino]thiophene-3-carboxylate CAS Name: 4-(3-bromophenyl)-2-[[(4-ethoxyphenyl)-oxomethyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-(3-bromophenyl)-2-[(4-ethoxybenzoyl)amino]thiophene-3-carboxylate Traditional Name: 4-(3-bromophenyl)-2-[(4-ethoxybenzoyl)amino]thiophene-3-carboxylic acid methyl ester Formula: C21H18BrNO4S MolecularWeight: 460.34092

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(=O)NC2=C(C(=CS2)C3=CC(=CC=C3)Br)C(=O)OC

Isomeric SMILES

CCOC1=CC=C(C=C1)C(=O)NC2=C(C(=CS2)C3=CC(=CC=C3)Br)C(=O)OC

InChI

InChI=1S/C21H18BrNO4S/c1-3-27-16-9-7-13(8-10-16)19(24)23-20-18(21(25)26-2)17(12-28-20)14-5-4-6-15(22)11-14/h4-12H,3H2,1-2H3,(H,23,24)