1-[5-[(2-chlorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-2-(3-ethoxy-4-propoxy-phenyl)-4-oxidanyl-3-thiophen-2-ylcarbonyl-2H-pyrrol-5-one

Systemtic Name: 1-[5-[(2-chlorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-2-(3-ethoxy-4-propoxy-phenyl)-4-oxidanyl-3-thiophen-2-ylcarbonyl-2H-pyrrol-5-one Openeye Name: 1-[5-[(2-chlorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-2-(3-ethoxy-4-propoxy-phenyl)-4-hydroxy-3-(thiophene-2-carbonyl)-2H-pyrrol-5-one CAS Name: 1-[5-[(2-chlorophenyl)methylthio]-1,3,4-thiadiazol-2-yl]-2-(3-ethoxy-4-propoxyphenyl)-4-hydroxy-3-[oxo(thiophen-2-yl)methyl]-2H-pyrrol-5-one IUPAC Name: 1-[5-[(2-chlorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-2-(3-ethoxy-4-propoxyphenyl)-4-hydroxy-3-(thiophene-2-carbonyl)-2H-pyrrol-5-one Traditional Name: 1-[5-[(2-chlorobenzyl)thio]-1,3,4-thiadiazol-2-yl]-5-(3-ethoxy-4-propoxy-phenyl)-3-hydroxy-4-(2-thenoyl)-3-pyrrolin-2-one Formula: C29H26ClN3O5S3 MolecularWeight: 628.18184

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C2C(=C(C(=O)N2C3=NN=C(S3)SCC4=CC=CC=C4Cl)O)C(=O)C5=CC=CS5)OCC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)C2C(=C(C(=O)N2C3=NN=C(S3)SCC4=CC=CC=C4Cl)O)C(=O)C5=CC=CS5)OCC

InChI

InChI=1S/C29H26ClN3O5S3/c1-3-13-38-20-12-11-17(15-21(20)37-4-2)24-23(25(34)22-10-7-14-39-22)26(35)27(36)33(24)28-31-32-29(41-28)40-16-18-8-5-6-9-19(18)30/h5-12,14-15,24,35H,3-4,13,16H2,1-2H3