ethanol; 4-[(4E)-4-[(5Z)-3-ethyl-5-(5-methoxy-3-methyl-1,3-benzothiazol-2-ylidene)-4-oxidanylidene-1,3-thiazolidin-2-ylidene]-3-methyl-5-oxidanylidene-pyrazol-1-yl]benzoic acid

Systemtic Name: ethanol; 4-[(4E)-4-[(5Z)-3-ethyl-5-(5-methoxy-3-methyl-1,3-benzothiazol-2-ylidene)-4-oxidanylidene-1,3-thiazolidin-2-ylidene]-3-methyl-5-oxidanylidene-pyrazol-1-yl]benzoic acid Openeye Name: ethanol; 4-[(4E)-4-[(5Z)-3-ethyl-5-(5-methoxy-3-methyl-1,3-benzothiazol-2-ylidene)-4-oxo-thiazolidin-2-ylidene]-3-methyl-5-oxo-pyrazol-1-yl]benzoic acid CAS Name: ethanol; 4-[(4E)-4-[(5Z)-3-ethyl-5-(5-methoxy-3-methyl-1,3-benzothiazol-2-ylidene)-4-oxo-2-thiazolidinylidene]-3-methyl-5-oxo-1-pyrazolyl]benzoic acid IUPAC Name: ethanol; 4-[(4E)-4-[(5Z)-3-ethyl-5-(5-methoxy-3-methyl-1,3-benzothiazol-2-ylidene)-4-oxo-1,3-thiazolidin-2-ylidene]-3-methyl-5-oxopyrazol-1-yl]benzoic acid Traditional Name: ethanol; 4-[(4E)-4-[(5Z)-3-ethyl-4-keto-5-(5-methoxy-3-methyl-1,3-benzothiazol-2-ylidene)thiazolidin-2-ylidene]-5-keto-3-methyl-2-pyrazolin-1-yl]benzoic acid Formula: C31H40N4O8S2 MolecularWeight: 660.8013

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C2C(=NN(C2=O)C3=CC=C(C=C3)C(=O)O)C)SC(=C4N(C5=C(S4)C=CC(=C5)OC)C)C1=O.CCO.CCO.CCO

Isomeric SMILES

CCN1/C(=C\2/C(=NN(C2=O)C3=CC=C(C=C3)C(=O)O)C)/S/C(=C\4/N(C5=C(S4)C=CC(=C5)OC)C)/C1=O.CCO.CCO.CCO

InChI

InChI=1S/C25H22N4O5S2.3C2H6O/c1-5-28-22(31)20(24-27(3)17-12-16(34-4)10-11-18(17)35-24)36-23(28)19-13(2)26-29(21(19)30)15-8-6-14(7-9-15)25(32)33;3*1-2-3/h6-12H,5H2,1-4H3,(H,32,33);3*3H,2H2,1H3/b23-19+,24-20-;;;