methyl 3-[(2-chloranyl-4-methylsulfonyl-phenyl)methyl]-2-methyl-imidazo[4,5-b]pyridine-5-carboxylate

Systemtic Name: methyl 3-[(2-chloranyl-4-methylsulfonyl-phenyl)methyl]-2-methyl-imidazo[4,5-b]pyridine-5-carboxylate Openeye Name: methyl 3-[(2-chloro-4-methylsulfonyl-phenyl)methyl]-2-methyl-imidazo[4,5-b]pyridine-5-carboxylate CAS Name: 3-[(2-chloro-4-methylsulfonylphenyl)methyl]-2-methyl-5-imidazo[4,5-b]pyridinecarboxylic acid methyl ester IUPAC Name: methyl 3-[(2-chloro-4-methylsulfonylphenyl)methyl]-2-methylimidazo[4,5-b]pyridine-5-carboxylate Traditional Name: 3-(2-chloro-4-mesyl-benzyl)-2-methyl-imidazo[4,5-b]pyridine-5-carboxylic acid methyl ester Formula: C17H16ClN3O4S MolecularWeight: 393.84464

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(N1CC3=C(C=C(C=C3)S(=O)(=O)C)Cl)N=C(C=C2)C(=O)OC

Isomeric SMILES

CC1=NC2=C(N1CC3=C(C=C(C=C3)S(=O)(=O)C)Cl)N=C(C=C2)C(=O)OC

InChI

InChI=1S/C17H16ClN3O4S/c1-10-19-14-6-7-15(17(22)25-2)20-16(14)21(10)9-11-4-5-12(8-13(11)18)26(3,23)24/h4-8H,9H2,1-3H3