3-[(4-butoxy-2-chloranyl-phenyl)methyl]-2-methyl-N-(4-methylphenyl)sulfonyl-imidazo[4,5-b]pyridine-5-carboxamide

Systemtic Name: 3-[(4-butoxy-2-chloranyl-phenyl)methyl]-2-methyl-N-(4-methylphenyl)sulfonyl-imidazo[4,5-b]pyridine-5-carboxamide Openeye Name: 3-[(4-butoxy-2-chloro-phenyl)methyl]-2-methyl-N-(p-tolylsulfonyl)imidazo[4,5-b]pyridine-5-carboxamide CAS Name: 3-[(4-butoxy-2-chlorophenyl)methyl]-2-methyl-N-(4-methylphenyl)sulfonyl-5-imidazo[4,5-b]pyridinecarboxamide IUPAC Name: 3-[(4-butoxy-2-chlorophenyl)methyl]-2-methyl-N-(4-methylphenyl)sulfonylimidazo[4,5-b]pyridine-5-carboxamide Traditional Name: 3-(4-butoxy-2-chloro-benzyl)-2-methyl-N-tosyl-imidazo[4,5-b]pyridine-5-carboxamide Formula: C26H27ClN4O4S MolecularWeight: 527.03498

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC(=C(C=C1)CN2C(=NC3=C2N=C(C=C3)C(=O)NS(=O)(=O)C4=CC=C(C=C4)C)C)Cl

Isomeric SMILES

CCCCOC1=CC(=C(C=C1)CN2C(=NC3=C2N=C(C=C3)C(=O)NS(=O)(=O)C4=CC=C(C=C4)C)C)Cl

InChI

InChI=1S/C26H27ClN4O4S/c1-4-5-14-35-20-9-8-19(22(27)15-20)16-31-18(3)28-23-12-13-24(29-25(23)31)26(32)30-36(33,34)21-10-6-17(2)7-11-21/h6-13,15H,4-5,14,16H2,1-3H3,(H,30,32)