1-(6-methylpyridin-1-ium-2-yl)-4-oxidanyl-2-(3-phenoxyphenyl)-3-thiophen-2-ylcarbonyl-2H-pyrrol-5-one

Systemtic Name: 1-(6-methylpyridin-1-ium-2-yl)-4-oxidanyl-2-(3-phenoxyphenyl)-3-thiophen-2-ylcarbonyl-2H-pyrrol-5-one Openeye Name: 4-hydroxy-1-(6-methylpyridin-1-ium-2-yl)-2-(3-phenoxyphenyl)-3-(thiophene-2-carbonyl)-2H-pyrrol-5-one CAS Name: 4-hydroxy-1-(6-methyl-2-pyridin-1-iumyl)-3-[oxo(thiophen-2-yl)methyl]-2-(3-phenoxyphenyl)-2H-pyrrol-5-one IUPAC Name: 4-hydroxy-1-(6-methylpyridin-1-ium-2-yl)-2-(3-phenoxyphenyl)-3-(thiophene-2-carbonyl)-2H-pyrrol-5-one Traditional Name: 3-hydroxy-1-(6-methylpyridin-1-ium-2-yl)-5-(3-phenoxyphenyl)-4-(2-thenoyl)-3-pyrrolin-2-one Formula: C27H21N2O4S+ MolecularWeight: 469.53164

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[NH+]C(=CC=C1)N2C(C(=C(C2=O)O)C(=O)C3=CC=CS3)C4=CC(=CC=C4)OC5=CC=CC=C5

Isomeric SMILES

CC1=[NH+]C(=CC=C1)N2C(C(=C(C2=O)O)C(=O)C3=CC=CS3)C4=CC(=CC=C4)OC5=CC=CC=C5

InChI

InChI=1S/C27H20N2O4S/c1-17-8-5-14-22(28-17)29-24(23(26(31)27(29)32)25(30)21-13-7-15-34-21)18-9-6-12-20(16-18)33-19-10-3-2-4-11-19/h2-16,24,31H,1H3/p+1