ethyl 2-[(5-bromanyl-1-benzofuran-2-yl)carbonylamino]-4-(4-ethoxyphenyl)thiophene-3-carboxylate

Systemtic Name: ethyl 2-[(5-bromanyl-1-benzofuran-2-yl)carbonylamino]-4-(4-ethoxyphenyl)thiophene-3-carboxylate Openeye Name: ethyl 2-[(5-bromobenzofuran-2-carbonyl)amino]-4-(4-ethoxyphenyl)thiophene-3-carboxylate CAS Name: 2-[[(5-bromo-2-benzofuranyl)-oxomethyl]amino]-4-(4-ethoxyphenyl)-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(5-bromo-1-benzofuran-2-carbonyl)amino]-4-(4-ethoxyphenyl)thiophene-3-carboxylate Traditional Name: 2-[(5-bromobenzofuran-2-carbonyl)amino]-4-p-phenetyl-thiophene-3-carboxylic acid ethyl ester Formula: C24H20BrNO5S MolecularWeight: 514.3883

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=CSC(=C2C(=O)OCC)NC(=O)C3=CC4=C(O3)C=CC(=C4)Br

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=CSC(=C2C(=O)OCC)NC(=O)C3=CC4=C(O3)C=CC(=C4)Br

InChI

InChI=1S/C24H20BrNO5S/c1-3-29-17-8-5-14(6-9-17)18-13-32-23(21(18)24(28)30-4-2)26-22(27)20-12-15-11-16(25)7-10-19(15)31-20/h5-13H,3-4H2,1-2H3,(H,26,27)