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

Systemtic Name: methyl 4-(4-bromophenyl)-2-[(5-ethyl-3-methyl-1-benzofuran-2-yl)carbonylamino]-5-methyl-thiophene-3-carboxylate Openeye Name: methyl 4-(4-bromophenyl)-2-[(5-ethyl-3-methyl-benzofuran-2-carbonyl)amino]-5-methyl-thiophene-3-carboxylate CAS Name: 4-(4-bromophenyl)-2-[[(5-ethyl-3-methyl-2-benzofuranyl)-oxomethyl]amino]-5-methyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-(4-bromophenyl)-2-[(5-ethyl-3-methyl-1-benzofuran-2-carbonyl)amino]-5-methylthiophene-3-carboxylate Traditional Name: 4-(4-bromophenyl)-2-[(5-ethyl-3-methyl-benzofuran-2-carbonyl)amino]-5-methyl-thiophene-3-carboxylic acid methyl ester Formula: C25H22BrNO4S MolecularWeight: 512.41548

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)OC(=C2C)C(=O)NC3=C(C(=C(S3)C)C4=CC=C(C=C4)Br)C(=O)OC

Isomeric SMILES

CCC1=CC2=C(C=C1)OC(=C2C)C(=O)NC3=C(C(=C(S3)C)C4=CC=C(C=C4)Br)C(=O)OC

InChI

InChI=1S/C25H22BrNO4S/c1-5-15-6-11-19-18(12-15)13(2)22(31-19)23(28)27-24-21(25(29)30-4)20(14(3)32-24)16-7-9-17(26)10-8-16/h6-12H,5H2,1-4H3,(H,27,28)