2-(4-butoxy-3-ethoxy-phenyl)-1-(3-imidazol-1-ylpropyl)-4-oxidanyl-3-thiophen-2-ylcarbonyl-2H-pyrrol-5-one

Systemtic Name: 2-(4-butoxy-3-ethoxy-phenyl)-1-(3-imidazol-1-ylpropyl)-4-oxidanyl-3-thiophen-2-ylcarbonyl-2H-pyrrol-5-one Openeye Name: 2-(4-butoxy-3-ethoxy-phenyl)-4-hydroxy-1-(3-imidazol-1-ylpropyl)-3-(thiophene-2-carbonyl)-2H-pyrrol-5-one CAS Name: 2-(4-butoxy-3-ethoxyphenyl)-4-hydroxy-1-[3-(1-imidazolyl)propyl]-3-[oxo(thiophen-2-yl)methyl]-2H-pyrrol-5-one IUPAC Name: 2-(4-butoxy-3-ethoxyphenyl)-4-hydroxy-1-(3-imidazol-1-ylpropyl)-3-(thiophene-2-carbonyl)-2H-pyrrol-5-one Traditional Name: 5-(4-butoxy-3-ethoxy-phenyl)-3-hydroxy-1-(3-imidazol-1-ylpropyl)-4-(2-thenoyl)-3-pyrrolin-2-one Formula: C27H31N3O5S MolecularWeight: 509.61714

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C2C(=C(C(=O)N2CCCN3C=CN=C3)O)C(=O)C4=CC=CS4)OCC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)C2C(=C(C(=O)N2CCCN3C=CN=C3)O)C(=O)C4=CC=CS4)OCC

InChI

InChI=1S/C27H31N3O5S/c1-3-5-15-35-20-10-9-19(17-21(20)34-4-2)24-23(25(31)22-8-6-16-36-22)26(32)27(33)30(24)13-7-12-29-14-11-28-18-29/h6,8-11,14,16-18,24,32H,3-5,7,12-13,15H2,1-2H3