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

Systemtic Name: (4E)-4-[(3-ethoxyphenyl)-oxidanyl-methylidene]-5-pyridin-3-yl-1-(1,3-thiazol-2-yl)pyrrolidine-2,3-dione Openeye Name: (4E)-4-[(3-ethoxyphenyl)-hydroxy-methylene]-5-(3-pyridyl)-1-thiazol-2-yl-pyrrolidine-2,3-dione CAS Name: (4E)-4-[(3-ethoxyphenyl)-hydroxymethylidene]-5-(3-pyridinyl)-1-(2-thiazolyl)pyrrolidine-2,3-dione IUPAC Name: (4E)-4-[(3-ethoxyphenyl)-hydroxymethylidene]-5-pyridin-3-yl-1-(1,3-thiazol-2-yl)pyrrolidine-2,3-dione Traditional Name: (4E)-4-[hydroxy(m-phenetyl)methylene]-5-(3-pyridyl)-1-thiazol-2-yl-pyrrolidine-2,3-quinone Formula: C21H17N3O4S MolecularWeight: 407.44238

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1)C(=C2C(N(C(=O)C2=O)C3=NC=CS3)C4=CN=CC=C4)O

Isomeric SMILES

CCOC1=CC=CC(=C1)/C(=C\2/C(N(C(=O)C2=O)C3=NC=CS3)C4=CN=CC=C4)/O

InChI

InChI=1S/C21H17N3O4S/c1-2-28-15-7-3-5-13(11-15)18(25)16-17(14-6-4-8-22-12-14)24(20(27)19(16)26)21-23-9-10-29-21/h3-12,17,25H,2H2,1H3/b18-16+