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

Systemtic Name: 3-[(7-methoxy-1-benzofuran-2-yl)carbonyl]-4-oxidanyl-1-[5-(phenylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]-2-pyridin-3-yl-2H-pyrrol-5-one Openeye Name: 1-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)-4-hydroxy-3-(7-methoxybenzofuran-2-carbonyl)-2-(3-pyridyl)-2H-pyrrol-5-one CAS Name: 4-hydroxy-3-[(7-methoxy-2-benzofuranyl)-oxomethyl]-1-[5-(phenylmethylthio)-1,3,4-thiadiazol-2-yl]-2-(3-pyridinyl)-2H-pyrrol-5-one IUPAC Name: 1-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)-4-hydroxy-3-(7-methoxy-1-benzofuran-2-carbonyl)-2-pyridin-3-yl-2H-pyrrol-5-one Traditional Name: 1-[5-(benzylthio)-1,3,4-thiadiazol-2-yl]-3-hydroxy-4-(7-methoxybenzofuran-2-carbonyl)-5-(3-pyridyl)-3-pyrrolin-2-one Formula: C28H20N4O5S2 MolecularWeight: 556.6122

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC2=C1OC(=C2)C(=O)C3=C(C(=O)N(C3C4=CN=CC=C4)C5=NN=C(S5)SCC6=CC=CC=C6)O

Isomeric SMILES

COC1=CC=CC2=C1OC(=C2)C(=O)C3=C(C(=O)N(C3C4=CN=CC=C4)C5=NN=C(S5)SCC6=CC=CC=C6)O

InChI

InChI=1S/C28H20N4O5S2/c1-36-19-11-5-9-17-13-20(37-25(17)19)23(33)21-22(18-10-6-12-29-14-18)32(26(35)24(21)34)27-30-31-28(39-27)38-15-16-7-3-2-4-8-16/h2-14,22,34H,15H2,1H3