3-(1-benzofuran-2-ylcarbonyl)-1-[5-(naphthalen-1-ylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]-4-oxidanyl-2-pyridin-3-yl-2H-pyrrol-5-one

Systemtic Name: 3-(1-benzofuran-2-ylcarbonyl)-1-[5-(naphthalen-1-ylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]-4-oxidanyl-2-pyridin-3-yl-2H-pyrrol-5-one Openeye Name: 3-(benzofuran-2-carbonyl)-4-hydroxy-1-[5-(1-naphthylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]-2-(3-pyridyl)-2H-pyrrol-5-one CAS Name: 3-[2-benzofuranyl(oxo)methyl]-4-hydroxy-1-[5-(1-naphthalenylmethylthio)-1,3,4-thiadiazol-2-yl]-2-(3-pyridinyl)-2H-pyrrol-5-one IUPAC Name: 3-(1-benzofuran-2-carbonyl)-4-hydroxy-1-[5-(naphthalen-1-ylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]-2-pyridin-3-yl-2H-pyrrol-5-one Traditional Name: 4-(benzofuran-2-carbonyl)-3-hydroxy-1-[5-(1-naphthylmethylthio)-1,3,4-thiadiazol-2-yl]-5-(3-pyridyl)-3-pyrrolin-2-one Formula: C31H20N4O4S2 MolecularWeight: 576.6449

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2CSC3=NN=C(S3)N4C(C(=C(C4=O)O)C(=O)C5=CC6=CC=CC=C6O5)C7=CN=CC=C7

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2CSC3=NN=C(S3)N4C(C(=C(C4=O)O)C(=O)C5=CC6=CC=CC=C6O5)C7=CN=CC=C7

InChI

InChI=1S/C31H20N4O4S2/c36-27(24-15-19-8-2-4-13-23(19)39-24)25-26(20-11-6-14-32-16-20)35(29(38)28(25)37)30-33-34-31(41-30)40-17-21-10-5-9-18-7-1-3-12-22(18)21/h1-16,26,37H,17H2