3-(1-benzofuran-2-ylcarbonyl)-2-(5-methylfuran-2-yl)-1-[5-[(4-methylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-4-oxidanyl-2H-pyrrol-5-one

Systemtic Name: 3-(1-benzofuran-2-ylcarbonyl)-2-(5-methylfuran-2-yl)-1-[5-[(4-methylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-4-oxidanyl-2H-pyrrol-5-one Openeye Name: 3-(benzofuran-2-carbonyl)-4-hydroxy-2-(5-methyl-2-furyl)-1-[5-(p-tolylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]-2H-pyrrol-5-one CAS Name: 3-[2-benzofuranyl(oxo)methyl]-4-hydroxy-2-(5-methyl-2-furanyl)-1-[5-[(4-methylphenyl)methylthio]-1,3,4-thiadiazol-2-yl]-2H-pyrrol-5-one IUPAC Name: 3-(1-benzofuran-2-carbonyl)-4-hydroxy-2-(5-methylfuran-2-yl)-1-[5-[(4-methylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-2H-pyrrol-5-one Traditional Name: 4-(benzofuran-2-carbonyl)-3-hydroxy-1-[5-[(4-methylbenzyl)thio]-1,3,4-thiadiazol-2-yl]-5-(5-methyl-2-furyl)-3-pyrrolin-2-one Formula: C28H21N3O5S2 MolecularWeight: 543.61344

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSC2=NN=C(S2)N3C(C(=C(C3=O)O)C(=O)C4=CC5=CC=CC=C5O4)C6=CC=C(O6)C

Isomeric SMILES

CC1=CC=C(C=C1)CSC2=NN=C(S2)N3C(C(=C(C3=O)O)C(=O)C4=CC5=CC=CC=C5O4)C6=CC=C(O6)C

InChI

InChI=1S/C28H21N3O5S2/c1-15-7-10-17(11-8-15)14-37-28-30-29-27(38-28)31-23(20-12-9-16(2)35-20)22(25(33)26(31)34)24(32)21-13-18-5-3-4-6-19(18)36-21/h3-13,23,33H,14H2,1-2H3