(2S)-3-(1-benzofuran-2-ylcarbonyl)-2-(3-methoxy-4-pentoxy-phenyl)-4-oxidanyl-1-[5-(phenylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]-2H-pyrrol-5-one

Systemtic Name: (2S)-3-(1-benzofuran-2-ylcarbonyl)-2-(3-methoxy-4-pentoxy-phenyl)-4-oxidanyl-1-[5-(phenylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]-2H-pyrrol-5-one Openeye Name: (2S)-3-(benzofuran-2-carbonyl)-1-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)-4-hydroxy-2-(3-methoxy-4-pentoxy-phenyl)-2H-pyrrol-5-one CAS Name: (2S)-3-[2-benzofuranyl(oxo)methyl]-4-hydroxy-2-(3-methoxy-4-pentoxyphenyl)-1-[5-(phenylmethylthio)-1,3,4-thiadiazol-2-yl]-2H-pyrrol-5-one IUPAC Name: (2S)-3-(1-benzofuran-2-carbonyl)-1-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)-4-hydroxy-2-(3-methoxy-4-pentoxyphenyl)-2H-pyrrol-5-one Traditional Name: (5S)-5-(4-amoxy-3-methoxy-phenyl)-4-(benzofuran-2-carbonyl)-1-[5-(benzylthio)-1,3,4-thiadiazol-2-yl]-3-hydroxy-3-pyrrolin-2-one Formula: C34H31N3O6S2 MolecularWeight: 641.75644

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=C(C=C(C=C1)C2C(=C(C(=O)N2C3=NN=C(S3)SCC4=CC=CC=C4)O)C(=O)C5=CC6=CC=CC=C6O5)OC

Isomeric SMILES

CCCCCOC1=C(C=C(C=C1)[C@H]2C(=C(C(=O)N2C3=NN=C(S3)SCC4=CC=CC=C4)O)C(=O)C5=CC6=CC=CC=C6O5)OC

InChI

InChI=1S/C34H31N3O6S2/c1-3-4-10-17-42-25-16-15-23(19-26(25)41-2)29-28(30(38)27-18-22-13-8-9-14-24(22)43-27)31(39)32(40)37(29)33-35-36-34(45-33)44-20-21-11-6-5-7-12-21/h5-9,11-16,18-19,29,39H,3-4,10,17,20H2,1-2H3/t29-/m0/s1