2-[4-[(3-methoxy-4-oxidanyl-phenyl)methylidene]-5-oxidanylidene-2-phenyl-imidazol-1-yl]-1,3-benzothiazole-6-carboxylic acid

Systemtic Name: 2-[4-[(3-methoxy-4-oxidanyl-phenyl)methylidene]-5-oxidanylidene-2-phenyl-imidazol-1-yl]-1,3-benzothiazole-6-carboxylic acid Openeye Name: 2-[4-[(4-hydroxy-3-methoxy-phenyl)methylene]-5-oxo-2-phenyl-imidazol-1-yl]-1,3-benzothiazole-6-carboxylic acid CAS Name: 2-[4-[(4-hydroxy-3-methoxyphenyl)methylidene]-5-oxo-2-phenyl-1-imidazolyl]-1,3-benzothiazole-6-carboxylic acid IUPAC Name: 2-[4-[(4-hydroxy-3-methoxyphenyl)methylidene]-5-oxo-2-phenylimidazol-1-yl]-1,3-benzothiazole-6-carboxylic acid Traditional Name: 2-(5-keto-2-phenyl-4-vanillylidene-2-imidazolin-1-yl)-1,3-benzothiazole-6-carboxylic acid Formula: C25H17N3O5S MolecularWeight: 471.48458

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=C2C(=O)N(C(=N2)C3=CC=CC=C3)C4=NC5=C(S4)C=C(C=C5)C(=O)O)O

Isomeric SMILES

COC1=C(C=CC(=C1)C=C2C(=O)N(C(=N2)C3=CC=CC=C3)C4=NC5=C(S4)C=C(C=C5)C(=O)O)O

InChI

InChI=1S/C25H17N3O5S/c1-33-20-12-14(7-10-19(20)29)11-18-23(30)28(22(26-18)15-5-3-2-4-6-15)25-27-17-9-8-16(24(31)32)13-21(17)34-25/h2-13,29H,1H3,(H,31,32)