(4Z)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(oxidanyl)methylidene]-1-(4,6-dimethyl-1,3-benzothiazol-2-yl)-5-(4-phenylmethoxyphenyl)pyrrolidine-2,3-dione

Systemtic Name: (4Z)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(oxidanyl)methylidene]-1-(4,6-dimethyl-1,3-benzothiazol-2-yl)-5-(4-phenylmethoxyphenyl)pyrrolidine-2,3-dione Openeye Name: (4Z)-5-(4-benzyloxyphenyl)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylene]-1-(4,6-dimethyl-1,3-benzothiazol-2-yl)pyrrolidine-2,3-dione CAS Name: (4Z)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-1-(4,6-dimethyl-1,3-benzothiazol-2-yl)-5-(4-phenylmethoxyphenyl)pyrrolidine-2,3-dione IUPAC Name: (4Z)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-1-(4,6-dimethyl-1,3-benzothiazol-2-yl)-5-(4-phenylmethoxyphenyl)pyrrolidine-2,3-dione Traditional Name: (4Z)-5-(4-benzoxyphenyl)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylene]-1-(4,6-dimethyl-1,3-benzothiazol-2-yl)pyrrolidine-2,3-quinone Formula: C35H28N2O6S MolecularWeight: 604.67162

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)SC(=N2)N3C(C(=C(C4=CC5=C(C=C4)OCCO5)O)C(=O)C3=O)C6=CC=C(C=C6)OCC7=CC=CC=C7)C

Isomeric SMILES

CC1=CC(=C2C(=C1)SC(=N2)N3C(/C(=C(\C4=CC5=C(C=C4)OCCO5)/O)/C(=O)C3=O)C6=CC=C(C=C6)OCC7=CC=CC=C7)C

InChI

InChI=1S/C35H28N2O6S/c1-20-16-21(2)30-28(17-20)44-35(36-30)37-31(23-8-11-25(12-9-23)43-19-22-6-4-3-5-7-22)29(33(39)34(37)40)32(38)24-10-13-26-27(18-24)42-15-14-41-26/h3-13,16-18,31,38H,14-15,19H2,1-2H3/b32-29-