2-(5,6-dimethoxybenzimidazol-1-yl)-4-(4-ethenylphenyl)-1,3-thiazole-5-carboxylic acid

Systemtic Name: 2-(5,6-dimethoxybenzimidazol-1-yl)-4-(4-ethenylphenyl)-1,3-thiazole-5-carboxylic acid Openeye Name: 2-(5,6-dimethoxybenzimidazol-1-yl)-4-(4-vinylphenyl)thiazole-5-carboxylic acid CAS Name: 2-(5,6-dimethoxy-1-benzimidazolyl)-4-(4-ethenylphenyl)-5-thiazolecarboxylic acid IUPAC Name: 2-(5,6-dimethoxybenzimidazol-1-yl)-4-(4-ethenylphenyl)-1,3-thiazole-5-carboxylic acid Traditional Name: 2-(5,6-dimethoxybenzimidazol-1-yl)-4-(4-vinylphenyl)thiazole-5-carboxylic acid Formula: C21H17N3O4S MolecularWeight: 407.44238

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)N=CN2C3=NC(=C(S3)C(=O)O)C4=CC=C(C=C4)C=C)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)N=CN2C3=NC(=C(S3)C(=O)O)C4=CC=C(C=C4)C=C)OC

InChI

InChI=1S/C21H17N3O4S/c1-4-12-5-7-13(8-6-12)18-19(20(25)26)29-21(23-18)24-11-22-14-9-16(27-2)17(28-3)10-15(14)24/h4-11H,1H2,2-3H3,(H,25,26)