(2S)-2-(3-butoxyphenyl)-4-oxidanyl-1-(pyridin-3-ylmethyl)-3-thiophen-2-ylcarbonyl-2H-pyrrol-5-one

Systemtic Name: (2S)-2-(3-butoxyphenyl)-4-oxidanyl-1-(pyridin-3-ylmethyl)-3-thiophen-2-ylcarbonyl-2H-pyrrol-5-one Openeye Name: (2S)-2-(3-butoxyphenyl)-4-hydroxy-1-(3-pyridylmethyl)-3-(thiophene-2-carbonyl)-2H-pyrrol-5-one CAS Name: (2S)-2-(3-butoxyphenyl)-4-hydroxy-3-[oxo(thiophen-2-yl)methyl]-1-(3-pyridinylmethyl)-2H-pyrrol-5-one IUPAC Name: (2S)-2-(3-butoxyphenyl)-4-hydroxy-1-(pyridin-3-ylmethyl)-3-(thiophene-2-carbonyl)-2H-pyrrol-5-one Traditional Name: (5S)-5-(3-butoxyphenyl)-3-hydroxy-1-(3-pyridylmethyl)-4-(2-thenoyl)-3-pyrrolin-2-one Formula: C25H24N2O4S MolecularWeight: 448.53406

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC(=C1)C2C(=C(C(=O)N2CC3=CN=CC=C3)O)C(=O)C4=CC=CS4

Isomeric SMILES

CCCCOC1=CC=CC(=C1)[C@H]2C(=C(C(=O)N2CC3=CN=CC=C3)O)C(=O)C4=CC=CS4

InChI

InChI=1S/C25H24N2O4S/c1-2-3-12-31-19-9-4-8-18(14-19)22-21(23(28)20-10-6-13-32-20)24(29)25(30)27(22)16-17-7-5-11-26-15-17/h4-11,13-15,22,29H,2-3,12,16H2,1H3/t22-/m0/s1