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

Systemtic Name: 1-[5-[(2-chlorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-4-oxidanyl-2-(3-propoxyphenyl)-3-thiophen-2-ylcarbonyl-2H-pyrrol-5-one Openeye Name: 1-[5-[(2-chlorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-4-hydroxy-2-(3-propoxyphenyl)-3-(thiophene-2-carbonyl)-2H-pyrrol-5-one CAS Name: 1-[5-[(2-chlorophenyl)methylthio]-1,3,4-thiadiazol-2-yl]-4-hydroxy-3-[oxo(thiophen-2-yl)methyl]-2-(3-propoxyphenyl)-2H-pyrrol-5-one IUPAC Name: 1-[5-[(2-chlorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-4-hydroxy-2-(3-propoxyphenyl)-3-(thiophene-2-carbonyl)-2H-pyrrol-5-one Traditional Name: 1-[5-[(2-chlorobenzyl)thio]-1,3,4-thiadiazol-2-yl]-3-hydroxy-5-(3-propoxyphenyl)-4-(2-thenoyl)-3-pyrrolin-2-one Formula: C27H22ClN3O4S3 MolecularWeight: 584.12928

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H22ClN3O4S3/c1-2-12-35-18-9-5-8-16(14-18)22-21(23(32)20-11-6-13-36-20)24(33)25(34)31(22)26-29-30-27(38-26)37-15-17-7-3-4-10-19(17)28/h3-11,13-14,22,33H,2,12,15H2,1H3