3-[(2-chloranyl-4-thiophen-2-yl-phenyl)methyl]-2,7-dimethyl-imidazo[4,5-b]pyridine-5-carboxylic acid

Systemtic Name: 3-[(2-chloranyl-4-thiophen-2-yl-phenyl)methyl]-2,7-dimethyl-imidazo[4,5-b]pyridine-5-carboxylic acid Openeye Name: 3-[[2-chloro-4-(2-thienyl)phenyl]methyl]-2,7-dimethyl-imidazo[4,5-b]pyridine-5-carboxylic acid CAS Name: 3-[(2-chloro-4-thiophen-2-ylphenyl)methyl]-2,7-dimethyl-5-imidazo[4,5-b]pyridinecarboxylic acid IUPAC Name: 3-[(2-chloro-4-thiophen-2-ylphenyl)methyl]-2,7-dimethylimidazo[4,5-b]pyridine-5-carboxylic acid Traditional Name: 3-[2-chloro-4-(2-thienyl)benzyl]-2,7-dimethyl-imidazo[4,5-b]pyridine-5-carboxylic acid Formula: C20H16ClN3O2S MolecularWeight: 397.87794

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=C1N=C(N2CC3=C(C=C(C=C3)C4=CC=CS4)Cl)C)C(=O)O

Isomeric SMILES

CC1=CC(=NC2=C1N=C(N2CC3=C(C=C(C=C3)C4=CC=CS4)Cl)C)C(=O)O

InChI

InChI=1S/C20H16ClN3O2S/c1-11-8-16(20(25)26)23-19-18(11)22-12(2)24(19)10-14-6-5-13(9-15(14)21)17-4-3-7-27-17/h3-9H,10H2,1-2H3,(H,25,26)