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

Systemtic Name: (2S)-3-(1-benzofuran-2-ylcarbonyl)-4-oxidanyl-2-(4-phenylmethoxyphenyl)-1-[5-(phenylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]-2H-pyrrol-5-one Openeye Name: (2S)-3-(benzofuran-2-carbonyl)-2-(4-benzyloxyphenyl)-1-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)-4-hydroxy-2H-pyrrol-5-one CAS Name: (2S)-3-[2-benzofuranyl(oxo)methyl]-4-hydroxy-2-(4-phenylmethoxyphenyl)-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-(4-phenylmethoxyphenyl)-2H-pyrrol-5-one Traditional Name: (5S)-4-(benzofuran-2-carbonyl)-5-(4-benzoxyphenyl)-1-[5-(benzylthio)-1,3,4-thiadiazol-2-yl]-3-hydroxy-3-pyrrolin-2-one Formula: C35H25N3O5S2 MolecularWeight: 631.7201

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=C(C=C2)C3C(=C(C(=O)N3C4=NN=C(S4)SCC5=CC=CC=C5)O)C(=O)C6=CC7=CC=CC=C7O6

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=C(C=C2)[C@H]3C(=C(C(=O)N3C4=NN=C(S4)SCC5=CC=CC=C5)O)C(=O)C6=CC7=CC=CC=C7O6

InChI

InChI=1S/C35H25N3O5S2/c39-31(28-19-25-13-7-8-14-27(25)43-28)29-30(24-15-17-26(18-16-24)42-20-22-9-3-1-4-10-22)38(33(41)32(29)40)34-36-37-35(45-34)44-21-23-11-5-2-6-12-23/h1-19,30,40H,20-21H2/t30-/m0/s1