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

Systemtic Name: 1-[5-(naphthalen-1-ylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]-4-oxidanyl-2-(3-pentoxyphenyl)-3-thiophen-2-ylcarbonyl-2H-pyrrol-5-one Openeye Name: 4-hydroxy-1-[5-(1-naphthylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]-2-(3-pentoxyphenyl)-3-(thiophene-2-carbonyl)-2H-pyrrol-5-one CAS Name: 4-hydroxy-1-[5-(1-naphthalenylmethylthio)-1,3,4-thiadiazol-2-yl]-3-[oxo(thiophen-2-yl)methyl]-2-(3-pentoxyphenyl)-2H-pyrrol-5-one IUPAC Name: 4-hydroxy-1-[5-(naphthalen-1-ylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]-2-(3-pentoxyphenyl)-3-(thiophene-2-carbonyl)-2H-pyrrol-5-one Traditional Name: 5-(3-amoxyphenyl)-3-hydroxy-1-[5-(1-naphthylmethylthio)-1,3,4-thiadiazol-2-yl]-4-(2-thenoyl)-3-pyrrolin-2-one Formula: C33H29N3O4S3 MolecularWeight: 627.79606

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=CC(=C1)C2C(=C(C(=O)N2C3=NN=C(S3)SCC4=CC=CC5=CC=CC=C54)O)C(=O)C6=CC=CS6

Isomeric SMILES

CCCCCOC1=CC=CC(=C1)C2C(=C(C(=O)N2C3=NN=C(S3)SCC4=CC=CC5=CC=CC=C54)O)C(=O)C6=CC=CS6

InChI

InChI=1S/C33H29N3O4S3/c1-2-3-6-17-40-24-14-8-12-22(19-24)28-27(29(37)26-16-9-18-41-26)30(38)31(39)36(28)32-34-35-33(43-32)42-20-23-13-7-11-21-10-4-5-15-25(21)23/h4-5,7-16,18-19,28,38H,2-3,6,17,20H2,1H3