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

Systemtic Name: ethyl 2-[(5-bromanyl-3-methyl-1-benzofuran-2-yl)carbonylamino]-5-ethyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[(5-bromo-3-methyl-benzofuran-2-carbonyl)amino]-5-ethyl-thiophene-3-carboxylate CAS Name: 2-[[(5-bromo-3-methyl-2-benzofuranyl)-oxomethyl]amino]-5-ethyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(5-bromo-3-methyl-1-benzofuran-2-carbonyl)amino]-5-ethylthiophene-3-carboxylate Traditional Name: 2-[(5-bromo-3-methyl-benzofuran-2-carbonyl)amino]-5-ethyl-thiophene-3-carboxylic acid ethyl ester Formula: C19H18BrNO4S MolecularWeight: 436.31952

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(S1)NC(=O)C2=C(C3=C(O2)C=CC(=C3)Br)C)C(=O)OCC

Isomeric SMILES

CCC1=CC(=C(S1)NC(=O)C2=C(C3=C(O2)C=CC(=C3)Br)C)C(=O)OCC

InChI

InChI=1S/C19H18BrNO4S/c1-4-12-9-14(19(23)24-5-2)18(26-12)21-17(22)16-10(3)13-8-11(20)6-7-15(13)25-16/h6-9H,4-5H2,1-3H3,(H,21,22)