1-(4,6-dimethyl-1,3-benzothiazol-2-yl)-3-[(7-methoxy-1-benzofuran-2-yl)carbonyl]-4-oxidanyl-2-(3-phenylmethoxyphenyl)-2H-pyrrol-5-one

Systemtic Name: 1-(4,6-dimethyl-1,3-benzothiazol-2-yl)-3-[(7-methoxy-1-benzofuran-2-yl)carbonyl]-4-oxidanyl-2-(3-phenylmethoxyphenyl)-2H-pyrrol-5-one Openeye Name: 2-(3-benzyloxyphenyl)-1-(4,6-dimethyl-1,3-benzothiazol-2-yl)-4-hydroxy-3-(7-methoxybenzofuran-2-carbonyl)-2H-pyrrol-5-one CAS Name: 1-(4,6-dimethyl-1,3-benzothiazol-2-yl)-4-hydroxy-3-[(7-methoxy-2-benzofuranyl)-oxomethyl]-2-(3-phenylmethoxyphenyl)-2H-pyrrol-5-one IUPAC Name: 1-(4,6-dimethyl-1,3-benzothiazol-2-yl)-4-hydroxy-3-(7-methoxy-1-benzofuran-2-carbonyl)-2-(3-phenylmethoxyphenyl)-2H-pyrrol-5-one Traditional Name: 5-(3-benzoxyphenyl)-1-(4,6-dimethyl-1,3-benzothiazol-2-yl)-3-hydroxy-4-(7-methoxybenzofuran-2-carbonyl)-3-pyrrolin-2-one Formula: C36H28N2O6S MolecularWeight: 616.68232

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)SC(=N2)N3C(C(=C(C3=O)O)C(=O)C4=CC5=C(O4)C(=CC=C5)OC)C6=CC(=CC=C6)OCC7=CC=CC=C7)C

Isomeric SMILES

CC1=CC(=C2C(=C1)SC(=N2)N3C(C(=C(C3=O)O)C(=O)C4=CC5=C(O4)C(=CC=C5)OC)C6=CC(=CC=C6)OCC7=CC=CC=C7)C

InChI

InChI=1S/C36H28N2O6S/c1-20-15-21(2)30-28(16-20)45-36(37-30)38-31(23-11-7-13-25(17-23)43-19-22-9-5-4-6-10-22)29(33(40)35(38)41)32(39)27-18-24-12-8-14-26(42-3)34(24)44-27/h4-18,31,40H,19H2,1-3H3