(4E)-5-(4-bromophenyl)-1-(6-methoxy-1,3-benzothiazol-2-yl)-4-[oxidanyl(phenyl)methylidene]pyrrolidine-2,3-dione

Systemtic Name: (4E)-5-(4-bromophenyl)-1-(6-methoxy-1,3-benzothiazol-2-yl)-4-[oxidanyl(phenyl)methylidene]pyrrolidine-2,3-dione Openeye Name: (4E)-5-(4-bromophenyl)-4-[hydroxy(phenyl)methylene]-1-(6-methoxy-1,3-benzothiazol-2-yl)pyrrolidine-2,3-dione CAS Name: (4E)-5-(4-bromophenyl)-4-[hydroxy(phenyl)methylidene]-1-(6-methoxy-1,3-benzothiazol-2-yl)pyrrolidine-2,3-dione IUPAC Name: (4E)-5-(4-bromophenyl)-4-[hydroxy(phenyl)methylidene]-1-(6-methoxy-1,3-benzothiazol-2-yl)pyrrolidine-2,3-dione Traditional Name: (4E)-5-(4-bromophenyl)-4-[hydroxy(phenyl)methylene]-1-(6-methoxy-1,3-benzothiazol-2-yl)pyrrolidine-2,3-quinone Formula: C25H17BrN2O4S MolecularWeight: 521.38248

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N=C(S2)N3C(C(=C(C4=CC=CC=C4)O)C(=O)C3=O)C5=CC=C(C=C5)Br

Isomeric SMILES

COC1=CC2=C(C=C1)N=C(S2)N3C(/C(=C(/C4=CC=CC=C4)\O)/C(=O)C3=O)C5=CC=C(C=C5)Br

InChI

InChI=1S/C25H17BrN2O4S/c1-32-17-11-12-18-19(13-17)33-25(27-18)28-21(14-7-9-16(26)10-8-14)20(23(30)24(28)31)22(29)15-5-3-2-4-6-15/h2-13,21,29H,1H3/b22-20+