2-(4-bromophenyl)-1-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxidanyl-3-thiophen-2-ylcarbonyl-2H-pyrrol-5-one

Systemtic Name: 2-(4-bromophenyl)-1-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxidanyl-3-thiophen-2-ylcarbonyl-2H-pyrrol-5-one Openeye Name: 2-(4-bromophenyl)-1-[2-(3,4-dimethoxyphenyl)ethyl]-4-hydroxy-3-(thiophene-2-carbonyl)-2H-pyrrol-5-one CAS Name: 2-(4-bromophenyl)-1-[2-(3,4-dimethoxyphenyl)ethyl]-4-hydroxy-3-[oxo(thiophen-2-yl)methyl]-2H-pyrrol-5-one IUPAC Name: 2-(4-bromophenyl)-1-[2-(3,4-dimethoxyphenyl)ethyl]-4-hydroxy-3-(thiophene-2-carbonyl)-2H-pyrrol-5-one Traditional Name: 5-(4-bromophenyl)-1-homoveratryl-3-hydroxy-4-(2-thenoyl)-3-pyrrolin-2-one Formula: C25H22BrNO5S MolecularWeight: 528.41488

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCN2C(C(=C(C2=O)O)C(=O)C3=CC=CS3)C4=CC=C(C=C4)Br)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCN2C(C(=C(C2=O)O)C(=O)C3=CC=CS3)C4=CC=C(C=C4)Br)OC

InChI

InChI=1S/C25H22BrNO5S/c1-31-18-10-5-15(14-19(18)32-2)11-12-27-22(16-6-8-17(26)9-7-16)21(24(29)25(27)30)23(28)20-4-3-13-33-20/h3-10,13-14,22,29H,11-12H2,1-2H3