(2S)-1-(6-fluoranyl-1,3-benzothiazol-2-yl)-2-(2-methoxyphenyl)-5-oxidanylidene-3-thiophen-2-ylcarbonyl-2H-pyrrol-4-olate

Systemtic Name: (2S)-1-(6-fluoranyl-1,3-benzothiazol-2-yl)-2-(2-methoxyphenyl)-5-oxidanylidene-3-thiophen-2-ylcarbonyl-2H-pyrrol-4-olate Openeye Name: (2S)-1-(6-fluoro-1,3-benzothiazol-2-yl)-2-(2-methoxyphenyl)-5-oxo-3-(thiophene-2-carbonyl)-2H-pyrrol-4-olate CAS Name: (2S)-1-(6-fluoro-1,3-benzothiazol-2-yl)-2-(2-methoxyphenyl)-5-oxo-3-[oxo(thiophen-2-yl)methyl]-2H-pyrrol-4-olate IUPAC Name: (2S)-1-(6-fluoro-1,3-benzothiazol-2-yl)-2-(2-methoxyphenyl)-5-oxo-3-(thiophene-2-carbonyl)-2H-pyrrol-4-olate Traditional Name: (5S)-1-(6-fluoro-1,3-benzothiazol-2-yl)-2-keto-5-(2-methoxyphenyl)-4-(2-thenoyl)-3-pyrrolin-3-olate Formula: C23H14FN2O4S2- MolecularWeight: 465.496663

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C2C(=C(C(=O)N2C3=NC4=C(S3)C=C(C=C4)F)[O-])C(=O)C5=CC=CS5

Isomeric SMILES

COC1=CC=CC=C1[C@H]2C(=C(C(=O)N2C3=NC4=C(S3)C=C(C=C4)F)[O-])C(=O)C5=CC=CS5

InChI

InChI=1S/C23H15FN2O4S2/c1-30-15-6-3-2-5-13(15)19-18(20(27)16-7-4-10-31-16)21(28)22(29)26(19)23-25-14-9-8-12(24)11-17(14)32-23/h2-11,19,28H,1H3/p-1/t19-/m0/s1