(2S)-2-(4-ethoxyphenyl)-1-(6-ethyl-1,3-benzothiazol-2-yl)-3-(furan-2-ylcarbonyl)-5-oxidanylidene-2H-pyrrol-4-olate

Systemtic Name: (2S)-2-(4-ethoxyphenyl)-1-(6-ethyl-1,3-benzothiazol-2-yl)-3-(furan-2-ylcarbonyl)-5-oxidanylidene-2H-pyrrol-4-olate Openeye Name: (2S)-2-(4-ethoxyphenyl)-1-(6-ethyl-1,3-benzothiazol-2-yl)-3-(furan-2-carbonyl)-5-oxo-2H-pyrrol-4-olate CAS Name: (2S)-2-(4-ethoxyphenyl)-1-(6-ethyl-1,3-benzothiazol-2-yl)-3-[2-furanyl(oxo)methyl]-5-oxo-2H-pyrrol-4-olate IUPAC Name: (2S)-2-(4-ethoxyphenyl)-1-(6-ethyl-1,3-benzothiazol-2-yl)-3-(furan-2-carbonyl)-5-oxo-2H-pyrrol-4-olate Traditional Name: (5S)-1-(6-ethyl-1,3-benzothiazol-2-yl)-4-(2-furoyl)-2-keto-5-p-phenetyl-3-pyrrolin-3-olate Formula: C26H21N2O5S- MolecularWeight: 473.52034

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)N=C(S2)N3C(C(=C(C3=O)[O-])C(=O)C4=CC=CO4)C5=CC=C(C=C5)OCC

Isomeric SMILES

CCC1=CC2=C(C=C1)N=C(S2)N3[C@H](C(=C(C3=O)[O-])C(=O)C4=CC=CO4)C5=CC=C(C=C5)OCC

InChI

InChI=1S/C26H22N2O5S/c1-3-15-7-12-18-20(14-15)34-26(27-18)28-22(16-8-10-17(11-9-16)32-4-2)21(24(30)25(28)31)23(29)19-6-5-13-33-19/h5-14,22,30H,3-4H2,1-2H3/p-1/t22-/m0/s1