(4E)-4-[(4-chlorophenyl)-oxidanyl-methylidene]-1-(6-ethyl-1,3-benzothiazol-2-yl)-5-(4-prop-2-enoxyphenyl)pyrrolidine-2,3-dione

Systemtic Name: (4E)-4-[(4-chlorophenyl)-oxidanyl-methylidene]-1-(6-ethyl-1,3-benzothiazol-2-yl)-5-(4-prop-2-enoxyphenyl)pyrrolidine-2,3-dione Openeye Name: (4E)-5-(4-allyloxyphenyl)-4-[(4-chlorophenyl)-hydroxy-methylene]-1-(6-ethyl-1,3-benzothiazol-2-yl)pyrrolidine-2,3-dione CAS Name: (4E)-4-[(4-chlorophenyl)-hydroxymethylidene]-1-(6-ethyl-1,3-benzothiazol-2-yl)-5-(4-prop-2-enoxyphenyl)pyrrolidine-2,3-dione IUPAC Name: (4E)-4-[(4-chlorophenyl)-hydroxymethylidene]-1-(6-ethyl-1,3-benzothiazol-2-yl)-5-(4-prop-2-enoxyphenyl)pyrrolidine-2,3-dione Traditional Name: (4E)-5-(4-allyloxyphenyl)-4-[(4-chlorophenyl)-hydroxy-methylene]-1-(6-ethyl-1,3-benzothiazol-2-yl)pyrrolidine-2,3-quinone Formula: C29H23ClN2O4S MolecularWeight: 531.02192

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)N=C(S2)N3C(C(=C(C4=CC=C(C=C4)Cl)O)C(=O)C3=O)C5=CC=C(C=C5)OCC=C

Isomeric SMILES

CCC1=CC2=C(C=C1)N=C(S2)N3C(/C(=C(/C4=CC=C(C=C4)Cl)\O)/C(=O)C3=O)C5=CC=C(C=C5)OCC=C

InChI

InChI=1S/C29H23ClN2O4S/c1-3-15-36-21-12-8-18(9-13-21)25-24(26(33)19-6-10-20(30)11-7-19)27(34)28(35)32(25)29-31-22-14-5-17(4-2)16-23(22)37-29/h3,5-14,16,25,33H,1,4,15H2,2H3/b26-24+