(4E)-1-(6-methyl-1,3-benzothiazol-2-yl)-4-[oxidanyl(pyridin-4-yl)methylidene]-5-(4-propoxyphenyl)pyrrolidine-2,3-dione

Systemtic Name: (4E)-1-(6-methyl-1,3-benzothiazol-2-yl)-4-[oxidanyl(pyridin-4-yl)methylidene]-5-(4-propoxyphenyl)pyrrolidine-2,3-dione Openeye Name: (4E)-4-[hydroxy(4-pyridyl)methylene]-1-(6-methyl-1,3-benzothiazol-2-yl)-5-(4-propoxyphenyl)pyrrolidine-2,3-dione CAS Name: (4E)-4-[hydroxy(pyridin-4-yl)methylidene]-1-(6-methyl-1,3-benzothiazol-2-yl)-5-(4-propoxyphenyl)pyrrolidine-2,3-dione IUPAC Name: (4E)-4-[hydroxy(pyridin-4-yl)methylidene]-1-(6-methyl-1,3-benzothiazol-2-yl)-5-(4-propoxyphenyl)pyrrolidine-2,3-dione Traditional Name: (4E)-4-[hydroxy(4-pyridyl)methylene]-1-(6-methyl-1,3-benzothiazol-2-yl)-5-(4-propoxyphenyl)pyrrolidine-2,3-quinone Formula: C27H23N3O4S MolecularWeight: 485.55422

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C2C(=C(C3=CC=NC=C3)O)C(=O)C(=O)N2C4=NC5=C(S4)C=C(C=C5)C

Isomeric SMILES

CCCOC1=CC=C(C=C1)C2/C(=C(/C3=CC=NC=C3)\O)/C(=O)C(=O)N2C4=NC5=C(S4)C=C(C=C5)C

InChI

InChI=1S/C27H23N3O4S/c1-3-14-34-19-7-5-17(6-8-19)23-22(24(31)18-10-12-28-13-11-18)25(32)26(33)30(23)27-29-20-9-4-16(2)15-21(20)35-27/h4-13,15,23,31H,3,14H2,1-2H3/b24-22+