(4E)-4-[(3-butoxyphenyl)-oxidanyl-methylidene]-5-pyridin-3-yl-1-(1,3-thiazol-2-yl)pyrrolidine-2,3-dione

Systemtic Name: (4E)-4-[(3-butoxyphenyl)-oxidanyl-methylidene]-5-pyridin-3-yl-1-(1,3-thiazol-2-yl)pyrrolidine-2,3-dione Openeye Name: (4E)-4-[(3-butoxyphenyl)-hydroxy-methylene]-5-(3-pyridyl)-1-thiazol-2-yl-pyrrolidine-2,3-dione CAS Name: (4E)-4-[(3-butoxyphenyl)-hydroxymethylidene]-5-(3-pyridinyl)-1-(2-thiazolyl)pyrrolidine-2,3-dione IUPAC Name: (4E)-4-[(3-butoxyphenyl)-hydroxymethylidene]-5-pyridin-3-yl-1-(1,3-thiazol-2-yl)pyrrolidine-2,3-dione Traditional Name: (4E)-4-[(3-butoxyphenyl)-hydroxy-methylene]-5-(3-pyridyl)-1-thiazol-2-yl-pyrrolidine-2,3-quinone Formula: C23H21N3O4S MolecularWeight: 435.49554

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC(=C1)C(=C2C(N(C(=O)C2=O)C3=NC=CS3)C4=CN=CC=C4)O

Isomeric SMILES

CCCCOC1=CC=CC(=C1)/C(=C\2/C(N(C(=O)C2=O)C3=NC=CS3)C4=CN=CC=C4)/O

InChI

InChI=1S/C23H21N3O4S/c1-2-3-11-30-17-8-4-6-15(13-17)20(27)18-19(16-7-5-9-24-14-16)26(22(29)21(18)28)23-25-10-12-31-23/h4-10,12-14,19,27H,2-3,11H2,1H3/b20-18+