1-[5-[(2,4-dichlorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-3-[(7-methoxy-1-benzofuran-2-yl)carbonyl]-4-oxidanyl-2-(3-phenylmethoxyphenyl)-2H-pyrrol-5-one

Systemtic Name: 1-[5-[(2,4-dichlorophenyl)methylsulfanyl]-1,3,4-thiadiazol-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-[5-[(2,4-dichlorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-4-hydroxy-3-(7-methoxybenzofuran-2-carbonyl)-2H-pyrrol-5-one CAS Name: 1-[5-[(2,4-dichlorophenyl)methylthio]-1,3,4-thiadiazol-2-yl]-4-hydroxy-3-[(7-methoxy-2-benzofuranyl)-oxomethyl]-2-(3-phenylmethoxyphenyl)-2H-pyrrol-5-one IUPAC Name: 1-[5-[(2,4-dichlorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-4-hydroxy-3-(7-methoxy-1-benzofuran-2-carbonyl)-2-(3-phenylmethoxyphenyl)-2H-pyrrol-5-one Traditional Name: 5-(3-benzoxyphenyl)-1-[5-[(2,4-dichlorobenzyl)thio]-1,3,4-thiadiazol-2-yl]-3-hydroxy-4-(7-methoxybenzofuran-2-carbonyl)-3-pyrrolin-2-one Formula: C36H25Cl2N3O6S2 MolecularWeight: 730.6362

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC2=C1OC(=C2)C(=O)C3=C(C(=O)N(C3C4=CC(=CC=C4)OCC5=CC=CC=C5)C6=NN=C(S6)SCC7=C(C=C(C=C7)Cl)Cl)O

Isomeric SMILES

COC1=CC=CC2=C1OC(=C2)C(=O)C3=C(C(=O)N(C3C4=CC(=CC=C4)OCC5=CC=CC=C5)C6=NN=C(S6)SCC7=C(C=C(C=C7)Cl)Cl)O

InChI

InChI=1S/C36H25Cl2N3O6S2/c1-45-27-12-6-10-22-16-28(47-33(22)27)31(42)29-30(21-9-5-11-25(15-21)46-18-20-7-3-2-4-8-20)41(34(44)32(29)43)35-39-40-36(49-35)48-19-23-13-14-24(37)17-26(23)38/h2-17,30,43H,18-19H2,1H3