2-(4-butoxy-3-methoxy-phenyl)-4-oxidanyl-1-phenethyl-3-thiophen-2-ylcarbonyl-2H-pyrrol-5-one

Systemtic Name: 2-(4-butoxy-3-methoxy-phenyl)-4-oxidanyl-1-phenethyl-3-thiophen-2-ylcarbonyl-2H-pyrrol-5-one Openeye Name: 2-(4-butoxy-3-methoxy-phenyl)-4-hydroxy-1-phenethyl-3-(thiophene-2-carbonyl)-2H-pyrrol-5-one CAS Name: 2-(4-butoxy-3-methoxyphenyl)-4-hydroxy-3-[oxo(thiophen-2-yl)methyl]-1-phenethyl-2H-pyrrol-5-one IUPAC Name: 2-(4-butoxy-3-methoxyphenyl)-4-hydroxy-1-phenethyl-3-(thiophene-2-carbonyl)-2H-pyrrol-5-one Traditional Name: 5-(4-butoxy-3-methoxy-phenyl)-3-hydroxy-1-phenethyl-4-(2-thenoyl)-3-pyrrolin-2-one Formula: C28H29NO5S MolecularWeight: 491.59856

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C2C(=C(C(=O)N2CCC3=CC=CC=C3)O)C(=O)C4=CC=CS4)OC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)C2C(=C(C(=O)N2CCC3=CC=CC=C3)O)C(=O)C4=CC=CS4)OC

InChI

InChI=1S/C28H29NO5S/c1-3-4-16-34-21-13-12-20(18-22(21)33-2)25-24(26(30)23-11-8-17-35-23)27(31)28(32)29(25)15-14-19-9-6-5-7-10-19/h5-13,17-18,25,31H,3-4,14-16H2,1-2H3