N-cyclohexyl-4-[[2-(phenylmethylsulfanyl)imidazo[4,5-b]pyridin-3-yl]methyl]benzamide

Systemtic Name: N-cyclohexyl-4-[[2-(phenylmethylsulfanyl)imidazo[4,5-b]pyridin-3-yl]methyl]benzamide Openeye Name: 4-[(2-benzylsulfanylimidazo[4,5-b]pyridin-3-yl)methyl]-N-cyclohexyl-benzamide CAS Name: N-cyclohexyl-4-[[2-(phenylmethylthio)-3-imidazo[4,5-b]pyridinyl]methyl]benzamide IUPAC Name: 4-[(2-benzylsulfanylimidazo[4,5-b]pyridin-3-yl)methyl]-N-cyclohexylbenzamide Traditional Name: 4-[[2-(benzylthio)imidazo[4,5-b]pyridin-3-yl]methyl]-N-cyclohexyl-benzamide Formula: C27H28N4OS MolecularWeight: 456.60242

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)C2=CC=C(C=C2)CN3C4=C(C=CC=N4)N=C3SCC5=CC=CC=C5

Isomeric SMILES

C1CCC(CC1)NC(=O)C2=CC=C(C=C2)CN3C4=C(C=CC=N4)N=C3SCC5=CC=CC=C5

InChI

InChI=1S/C27H28N4OS/c32-26(29-23-10-5-2-6-11-23)22-15-13-20(14-16-22)18-31-25-24(12-7-17-28-25)30-27(31)33-19-21-8-3-1-4-9-21/h1,3-4,7-9,12-17,23H,2,5-6,10-11,18-19H2,(H,29,32)