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

Systemtic Name: 2-[(4Z)-4-[(4-methylsulfanylphenyl)methylidene]-5-oxidanylidene-2-phenyl-imidazol-1-yl]-1,3-benzothiazole-6-carboxylic acid Openeye Name: 2-[(4Z)-4-[(4-methylsulfanylphenyl)methylene]-5-oxo-2-phenyl-imidazol-1-yl]-1,3-benzothiazole-6-carboxylic acid CAS Name: 2-[(4Z)-4-[[4-(methylthio)phenyl]methylidene]-5-oxo-2-phenyl-1-imidazolyl]-1,3-benzothiazole-6-carboxylic acid IUPAC Name: 2-[(4Z)-4-[(4-methylsulfanylphenyl)methylidene]-5-oxo-2-phenylimidazol-1-yl]-1,3-benzothiazole-6-carboxylic acid Traditional Name: 2-[(4Z)-5-keto-4-[4-(methylthio)benzylidene]-2-phenyl-2-imidazolin-1-yl]-1,3-benzothiazole-6-carboxylic acid Formula: C25H17N3O3S2 MolecularWeight: 471.55078

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C=C2C(=O)N(C(=N2)C3=CC=CC=C3)C4=NC5=C(S4)C=C(C=C5)C(=O)O

Isomeric SMILES

CSC1=CC=C(C=C1)/C=C\2/C(=O)N(C(=N2)C3=CC=CC=C3)C4=NC5=C(S4)C=C(C=C5)C(=O)O

InChI

InChI=1S/C25H17N3O3S2/c1-32-18-10-7-15(8-11-18)13-20-23(29)28(22(26-20)16-5-3-2-4-6-16)25-27-19-12-9-17(24(30)31)14-21(19)33-25/h2-14H,1H3,(H,30,31)/b20-13-