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

Systemtic Name: methyl 3-[(2-chloranyl-4-thiophen-2-yl-phenyl)methyl]-2,7-dimethyl-imidazo[4,5-b]pyridine-5-carboxylate Openeye Name: methyl 3-[[2-chloro-4-(2-thienyl)phenyl]methyl]-2,7-dimethyl-imidazo[4,5-b]pyridine-5-carboxylate CAS Name: 3-[(2-chloro-4-thiophen-2-ylphenyl)methyl]-2,7-dimethyl-5-imidazo[4,5-b]pyridinecarboxylic acid methyl ester IUPAC Name: methyl 3-[(2-chloro-4-thiophen-2-ylphenyl)methyl]-2,7-dimethylimidazo[4,5-b]pyridine-5-carboxylate Traditional Name: 3-[2-chloro-4-(2-thienyl)benzyl]-2,7-dimethyl-imidazo[4,5-b]pyridine-5-carboxylic acid methyl ester Formula: C21H18ClN3O2S MolecularWeight: 411.90452

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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)OC

Isomeric SMILES

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

InChI

InChI=1S/C21H18ClN3O2S/c1-12-9-17(21(26)27-3)24-20-19(12)23-13(2)25(20)11-15-7-6-14(10-16(15)22)18-5-4-8-28-18/h4-10H,11H2,1-3H3