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

Systemtic Name: 2-(3-butoxyphenyl)-1-[5-[(2,4-dichlorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-3-[(7-methoxy-1-benzofuran-2-yl)carbonyl]-4-oxidanyl-2H-pyrrol-5-one Openeye Name: 2-(3-butoxyphenyl)-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: 2-(3-butoxyphenyl)-1-[5-[(2,4-dichlorophenyl)methylthio]-1,3,4-thiadiazol-2-yl]-4-hydroxy-3-[(7-methoxy-2-benzofuranyl)-oxomethyl]-2H-pyrrol-5-one IUPAC Name: 2-(3-butoxyphenyl)-1-[5-[(2,4-dichlorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-4-hydroxy-3-(7-methoxy-1-benzofuran-2-carbonyl)-2H-pyrrol-5-one Traditional Name: 5-(3-butoxyphenyl)-1-[5-[(2,4-dichlorobenzyl)thio]-1,3,4-thiadiazol-2-yl]-3-hydroxy-4-(7-methoxybenzofuran-2-carbonyl)-3-pyrrolin-2-one Formula: C33H27Cl2N3O6S2 MolecularWeight: 696.61998

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC(=C1)C2C(=C(C(=O)N2C3=NN=C(S3)SCC4=C(C=C(C=C4)Cl)Cl)O)C(=O)C5=CC6=C(O5)C(=CC=C6)OC

Isomeric SMILES

CCCCOC1=CC=CC(=C1)C2C(=C(C(=O)N2C3=NN=C(S3)SCC4=C(C=C(C=C4)Cl)Cl)O)C(=O)C5=CC6=C(O5)C(=CC=C6)OC

InChI

InChI=1S/C33H27Cl2N3O6S2/c1-3-4-13-43-22-9-5-7-18(14-22)27-26(28(39)25-15-19-8-6-10-24(42-2)30(19)44-25)29(40)31(41)38(27)32-36-37-33(46-32)45-17-20-11-12-21(34)16-23(20)35/h5-12,14-16,27,40H,3-4,13,17H2,1-2H3