(2S)-2-(4-fluorophenyl)-5-oxidanylidene-1-(pyridin-3-ylmethyl)-3-thiophen-2-ylcarbonyl-2H-pyrrol-4-olate

Systemtic Name: (2S)-2-(4-fluorophenyl)-5-oxidanylidene-1-(pyridin-3-ylmethyl)-3-thiophen-2-ylcarbonyl-2H-pyrrol-4-olate Openeye Name: (2S)-2-(4-fluorophenyl)-5-oxo-1-(3-pyridylmethyl)-3-(thiophene-2-carbonyl)-2H-pyrrol-4-olate CAS Name: (2S)-2-(4-fluorophenyl)-5-oxo-3-[oxo(thiophen-2-yl)methyl]-1-(3-pyridinylmethyl)-2H-pyrrol-4-olate IUPAC Name: (2S)-2-(4-fluorophenyl)-5-oxo-1-(pyridin-3-ylmethyl)-3-(thiophene-2-carbonyl)-2H-pyrrol-4-olate Traditional Name: (5S)-5-(4-fluorophenyl)-2-keto-1-(3-pyridylmethyl)-4-(2-thenoyl)-3-pyrrolin-3-olate Formula: C21H14FN2O3S- MolecularWeight: 393.410863

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)CN2C(C(=C(C2=O)[O-])C(=O)C3=CC=CS3)C4=CC=C(C=C4)F

Isomeric SMILES

C1=CC(=CN=C1)CN2[C@H](C(=C(C2=O)[O-])C(=O)C3=CC=CS3)C4=CC=C(C=C4)F

InChI

InChI=1S/C21H15FN2O3S/c22-15-7-5-14(6-8-15)18-17(19(25)16-4-2-10-28-16)20(26)21(27)24(18)12-13-3-1-9-23-11-13/h1-11,18,26H,12H2/p-1/t18-/m0/s1