ethyl 2-[(2-bromanyl-3,4,5-trimethoxy-phenyl)carbonylamino]-5-phenyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[(2-bromanyl-3,4,5-trimethoxy-phenyl)carbonylamino]-5-phenyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[(2-bromo-3,4,5-trimethoxy-benzoyl)amino]-5-phenyl-thiophene-3-carboxylate CAS Name: 2-[[(2-bromo-3,4,5-trimethoxyphenyl)-oxomethyl]amino]-5-phenyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(2-bromo-3,4,5-trimethoxybenzoyl)amino]-5-phenylthiophene-3-carboxylate Traditional Name: 2-[(2-bromo-3,4,5-trimethoxy-benzoyl)amino]-5-phenyl-thiophene-3-carboxylic acid ethyl ester Formula: C23H22BrNO6S MolecularWeight: 520.39288

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1)C2=CC=CC=C2)NC(=O)C3=CC(=C(C(=C3Br)OC)OC)OC

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1)C2=CC=CC=C2)NC(=O)C3=CC(=C(C(=C3Br)OC)OC)OC

InChI

InChI=1S/C23H22BrNO6S/c1-5-31-23(27)15-12-17(13-9-7-6-8-10-13)32-22(15)25-21(26)14-11-16(28-2)19(29-3)20(30-4)18(14)24/h6-12H,5H2,1-4H3,(H,25,26)