(2S)-2-(3,4-dimethoxyphenyl)-1-(6-methylpyridin-2-yl)-5-oxidanylidene-3-thiophen-2-ylcarbonyl-2H-pyrrol-4-olate

Systemtic Name: (2S)-2-(3,4-dimethoxyphenyl)-1-(6-methylpyridin-2-yl)-5-oxidanylidene-3-thiophen-2-ylcarbonyl-2H-pyrrol-4-olate Openeye Name: (2S)-2-(3,4-dimethoxyphenyl)-1-(6-methyl-2-pyridyl)-5-oxo-3-(thiophene-2-carbonyl)-2H-pyrrol-4-olate CAS Name: (2S)-2-(3,4-dimethoxyphenyl)-1-(6-methyl-2-pyridinyl)-5-oxo-3-[oxo(thiophen-2-yl)methyl]-2H-pyrrol-4-olate IUPAC Name: (2S)-2-(3,4-dimethoxyphenyl)-1-(6-methylpyridin-2-yl)-5-oxo-3-(thiophene-2-carbonyl)-2H-pyrrol-4-olate Traditional Name: (5S)-5-(3,4-dimethoxyphenyl)-2-keto-1-(6-methyl-2-pyridyl)-4-(2-thenoyl)-3-pyrrolin-3-olate Formula: C23H19N2O5S- MolecularWeight: 435.47236

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC=C1)N2C(C(=C(C2=O)[O-])C(=O)C3=CC=CS3)C4=CC(=C(C=C4)OC)OC

Isomeric SMILES

CC1=NC(=CC=C1)N2[C@H](C(=C(C2=O)[O-])C(=O)C3=CC=CS3)C4=CC(=C(C=C4)OC)OC

InChI

InChI=1S/C23H20N2O5S/c1-13-6-4-8-18(24-13)25-20(14-9-10-15(29-2)16(12-14)30-3)19(22(27)23(25)28)21(26)17-7-5-11-31-17/h4-12,20,27H,1-3H3/p-1/t20-/m0/s1