(2R)-1-(3-imidazol-1-ylpropyl)-5-oxidanylidene-2-(3-propoxyphenyl)-3-thiophen-2-ylcarbonyl-2H-pyrrol-4-olate

Systemtic Name: (2R)-1-(3-imidazol-1-ylpropyl)-5-oxidanylidene-2-(3-propoxyphenyl)-3-thiophen-2-ylcarbonyl-2H-pyrrol-4-olate Openeye Name: (2R)-1-(3-imidazol-1-ylpropyl)-5-oxo-2-(3-propoxyphenyl)-3-(thiophene-2-carbonyl)-2H-pyrrol-4-olate CAS Name: (2R)-1-[3-(1-imidazolyl)propyl]-5-oxo-3-[oxo(thiophen-2-yl)methyl]-2-(3-propoxyphenyl)-2H-pyrrol-4-olate IUPAC Name: (2R)-1-(3-imidazol-1-ylpropyl)-5-oxo-2-(3-propoxyphenyl)-3-(thiophene-2-carbonyl)-2H-pyrrol-4-olate Traditional Name: (5R)-1-(3-imidazol-1-ylpropyl)-2-keto-5-(3-propoxyphenyl)-4-(2-thenoyl)-3-pyrrolin-3-olate Formula: C24H24N3O4S- MolecularWeight: 450.53006

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC(=C1)C2C(=C(C(=O)N2CCCN3C=CN=C3)[O-])C(=O)C4=CC=CS4

Isomeric SMILES

CCCOC1=CC=CC(=C1)[C@@H]2C(=C(C(=O)N2CCCN3C=CN=C3)[O-])C(=O)C4=CC=CS4

InChI

InChI=1S/C24H25N3O4S/c1-2-13-31-18-7-3-6-17(15-18)21-20(22(28)19-8-4-14-32-19)23(29)24(30)27(21)11-5-10-26-12-9-25-16-26/h3-4,6-9,12,14-16,21,29H,2,5,10-11,13H2,1H3/p-1/t21-/m1/s1