(2S)-1-(4,5-dimethyl-1,3-thiazol-2-yl)-2-(2-methoxyphenyl)-5-oxidanylidene-3-thiophen-2-ylcarbonyl-2H-pyrrol-4-olate

Systemtic Name: (2S)-1-(4,5-dimethyl-1,3-thiazol-2-yl)-2-(2-methoxyphenyl)-5-oxidanylidene-3-thiophen-2-ylcarbonyl-2H-pyrrol-4-olate Openeye Name: (2S)-1-(4,5-dimethylthiazol-2-yl)-2-(2-methoxyphenyl)-5-oxo-3-(thiophene-2-carbonyl)-2H-pyrrol-4-olate CAS Name: (2S)-1-(4,5-dimethyl-2-thiazolyl)-2-(2-methoxyphenyl)-5-oxo-3-[oxo(thiophen-2-yl)methyl]-2H-pyrrol-4-olate IUPAC Name: (2S)-1-(4,5-dimethyl-1,3-thiazol-2-yl)-2-(2-methoxyphenyl)-5-oxo-3-(thiophene-2-carbonyl)-2H-pyrrol-4-olate Traditional Name: (5S)-1-(4,5-dimethylthiazol-2-yl)-2-keto-5-(2-methoxyphenyl)-4-(2-thenoyl)-3-pyrrolin-3-olate Formula: C21H17N2O4S2- MolecularWeight: 425.50068

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)N2C(C(=C(C2=O)[O-])C(=O)C3=CC=CS3)C4=CC=CC=C4OC)C

Isomeric SMILES

CC1=C(SC(=N1)N2[C@H](C(=C(C2=O)[O-])C(=O)C3=CC=CS3)C4=CC=CC=C4OC)C

InChI

InChI=1S/C21H18N2O4S2/c1-11-12(2)29-21(22-11)23-17(13-7-4-5-8-14(13)27-3)16(19(25)20(23)26)18(24)15-9-6-10-28-15/h4-10,17,25H,1-3H3/p-1/t17-/m0/s1