(2R)-2-(2,3-dimethoxyphenyl)-1-(6-methyl-1,3-benzothiazol-2-yl)-5-oxidanylidene-3-thiophen-2-ylcarbonyl-2H-pyrrol-4-olate

Systemtic Name: (2R)-2-(2,3-dimethoxyphenyl)-1-(6-methyl-1,3-benzothiazol-2-yl)-5-oxidanylidene-3-thiophen-2-ylcarbonyl-2H-pyrrol-4-olate Openeye Name: (2R)-2-(2,3-dimethoxyphenyl)-1-(6-methyl-1,3-benzothiazol-2-yl)-5-oxo-3-(thiophene-2-carbonyl)-2H-pyrrol-4-olate CAS Name: (2R)-2-(2,3-dimethoxyphenyl)-1-(6-methyl-1,3-benzothiazol-2-yl)-5-oxo-3-[oxo(thiophen-2-yl)methyl]-2H-pyrrol-4-olate IUPAC Name: (2R)-2-(2,3-dimethoxyphenyl)-1-(6-methyl-1,3-benzothiazol-2-yl)-5-oxo-3-(thiophene-2-carbonyl)-2H-pyrrol-4-olate Traditional Name: (5R)-5-(2,3-dimethoxyphenyl)-2-keto-1-(6-methyl-1,3-benzothiazol-2-yl)-4-(2-thenoyl)-3-pyrrolin-3-olate Formula: C25H19N2O5S2- MolecularWeight: 491.55876

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)N3C(C(=C(C3=O)[O-])C(=O)C4=CC=CS4)C5=C(C(=CC=C5)OC)OC

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)N3[C@@H](C(=C(C3=O)[O-])C(=O)C4=CC=CS4)C5=C(C(=CC=C5)OC)OC

InChI

InChI=1S/C25H20N2O5S2/c1-13-9-10-15-18(12-13)34-25(26-15)27-20(14-6-4-7-16(31-2)23(14)32-3)19(22(29)24(27)30)21(28)17-8-5-11-33-17/h4-12,20,29H,1-3H3/p-1/t20-/m1/s1