4-[(3,4-dimethoxyphenyl)-oxidanyl-methylidene]-1-(pyridin-3-ylmethyl)-5-thiophen-2-yl-pyrrolidine-2,3-dione

Systemtic Name: 4-[(3,4-dimethoxyphenyl)-oxidanyl-methylidene]-1-(pyridin-3-ylmethyl)-5-thiophen-2-yl-pyrrolidine-2,3-dione Openeye Name: 4-[(3,4-dimethoxyphenyl)-hydroxy-methylene]-1-(3-pyridylmethyl)-5-(2-thienyl)pyrrolidine-2,3-dione CAS Name: 4-[(3,4-dimethoxyphenyl)-hydroxymethylidene]-1-(3-pyridinylmethyl)-5-thiophen-2-ylpyrrolidine-2,3-dione IUPAC Name: 4-[(3,4-dimethoxyphenyl)-hydroxymethylidene]-1-(pyridin-3-ylmethyl)-5-thiophen-2-ylpyrrolidine-2,3-dione Traditional Name: 4-[(3,4-dimethoxyphenyl)-hydroxy-methylene]-1-(3-pyridylmethyl)-5-(2-thienyl)pyrrolidine-2,3-quinone Formula: C23H20N2O5S MolecularWeight: 436.4803

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=C2C(N(C(=O)C2=O)CC3=CN=CC=C3)C4=CC=CS4)O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=C2C(N(C(=O)C2=O)CC3=CN=CC=C3)C4=CC=CS4)O)OC

InChI

InChI=1S/C23H20N2O5S/c1-29-16-8-7-15(11-17(16)30-2)21(26)19-20(18-6-4-10-31-18)25(23(28)22(19)27)13-14-5-3-9-24-12-14/h3-12,20,26H,13H2,1-2H3