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

Systemtic Name: 2-[3-(3-methylbutoxy)phenyl]-4-oxidanyl-1-(pyridin-4-ylmethyl)-3-thiophen-2-ylcarbonyl-2H-pyrrol-5-one Openeye Name: 4-hydroxy-2-(3-isopentyloxyphenyl)-1-(4-pyridylmethyl)-3-(thiophene-2-carbonyl)-2H-pyrrol-5-one CAS Name: 4-hydroxy-2-[3-(3-methylbutoxy)phenyl]-3-[oxo(thiophen-2-yl)methyl]-1-(pyridin-4-ylmethyl)-2H-pyrrol-5-one IUPAC Name: 4-hydroxy-2-[3-(3-methylbutoxy)phenyl]-1-(pyridin-4-ylmethyl)-3-(thiophene-2-carbonyl)-2H-pyrrol-5-one Traditional Name: 3-hydroxy-5-(3-isoamoxyphenyl)-1-(4-pyridylmethyl)-4-(2-thenoyl)-3-pyrrolin-2-one Formula: C26H26N2O4S MolecularWeight: 462.56064

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H26N2O4S/c1-17(2)10-13-32-20-6-3-5-19(15-20)23-22(24(29)21-7-4-14-33-21)25(30)26(31)28(23)16-18-8-11-27-12-9-18/h3-9,11-12,14-15,17,23,30H,10,13,16H2,1-2H3