2-[3-(3-methylbutoxy)phenyl]-4-oxidanyl-1-(phenylmethyl)-3-thiophen-2-ylcarbonyl-2H-pyrrol-5-one

Systemtic Name: 2-[3-(3-methylbutoxy)phenyl]-4-oxidanyl-1-(phenylmethyl)-3-thiophen-2-ylcarbonyl-2H-pyrrol-5-one Openeye Name: 1-benzyl-4-hydroxy-2-(3-isopentyloxyphenyl)-3-(thiophene-2-carbonyl)-2H-pyrrol-5-one CAS Name: 4-hydroxy-2-[3-(3-methylbutoxy)phenyl]-3-[oxo(thiophen-2-yl)methyl]-1-(phenylmethyl)-2H-pyrrol-5-one IUPAC Name: 1-benzyl-4-hydroxy-2-[3-(3-methylbutoxy)phenyl]-3-(thiophene-2-carbonyl)-2H-pyrrol-5-one Traditional Name: 1-benzyl-3-hydroxy-5-(3-isoamoxyphenyl)-4-(2-thenoyl)-3-pyrrolin-2-one Formula: C27H27NO4S MolecularWeight: 461.57258

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=CC=CC(=C1)C2C(=C(C(=O)N2CC3=CC=CC=C3)O)C(=O)C4=CC=CS4

Isomeric SMILES

CC(C)CCOC1=CC=CC(=C1)C2C(=C(C(=O)N2CC3=CC=CC=C3)O)C(=O)C4=CC=CS4

InChI

InChI=1S/C27H27NO4S/c1-18(2)13-14-32-21-11-6-10-20(16-21)24-23(25(29)22-12-7-15-33-22)26(30)27(31)28(24)17-19-8-4-3-5-9-19/h3-12,15-16,18,24,30H,13-14,17H2,1-2H3