4-[3-ethoxycarbonyl-4-[3-methyl-5-(3-methyl-1,3-benzothiazol-2-ylidene)-4-oxidanylidene-1,3-thiazolidin-2-ylidene]-5-oxidanylidene-pyrazol-1-yl]benzenesulfonic acid

Systemtic Name: 4-[3-ethoxycarbonyl-4-[3-methyl-5-(3-methyl-1,3-benzothiazol-2-ylidene)-4-oxidanylidene-1,3-thiazolidin-2-ylidene]-5-oxidanylidene-pyrazol-1-yl]benzenesulfonic acid Openeye Name: 4-[3-ethoxycarbonyl-4-[3-methyl-5-(3-methyl-1,3-benzothiazol-2-ylidene)-4-oxo-thiazolidin-2-ylidene]-5-oxo-pyrazol-1-yl]benzenesulfonic acid CAS Name: 4-[3-ethoxycarbonyl-4-[3-methyl-5-(3-methyl-1,3-benzothiazol-2-ylidene)-4-oxo-2-thiazolidinylidene]-5-oxo-1-pyrazolyl]benzenesulfonic acid IUPAC Name: 4-[3-ethoxycarbonyl-4-[3-methyl-5-(3-methyl-1,3-benzothiazol-2-ylidene)-4-oxo-1,3-thiazolidin-2-ylidene]-5-oxopyrazol-1-yl]benzenesulfonic acid Traditional Name: 4-[3-carbethoxy-5-keto-4-[4-keto-3-methyl-5-(3-methyl-1,3-benzothiazol-2-ylidene)thiazolidin-2-ylidene]-2-pyrazolin-1-yl]besylic acid Formula: C24H20N4O7S3 MolecularWeight: 572.6332

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(=O)C1=C2N(C(=O)C(=C3N(C4=CC=CC=C4S3)C)S2)C)C5=CC=C(C=C5)S(=O)(=O)O

Isomeric SMILES

CCOC(=O)C1=NN(C(=O)C1=C2N(C(=O)C(=C3N(C4=CC=CC=C4S3)C)S2)C)C5=CC=C(C=C5)S(=O)(=O)O

InChI

InChI=1S/C24H20N4O7S3/c1-4-35-24(31)18-17(20(29)28(25-18)13-9-11-14(12-10-13)38(32,33)34)22-27(3)21(30)19(37-22)23-26(2)15-7-5-6-8-16(15)36-23/h5-12H,4H2,1-3H3,(H,32,33,34)