N-(2-azanylcyclohexyl)-3-[(2-methylphenyl)methyl]-5-(2-phenylsulfanylethanoyl)-6,7-dihydro-4H-imidazo[4,5-c]pyridine-6-carboxamide

Systemtic Name: N-(2-azanylcyclohexyl)-3-[(2-methylphenyl)methyl]-5-(2-phenylsulfanylethanoyl)-6,7-dihydro-4H-imidazo[4,5-c]pyridine-6-carboxamide Openeye Name: N-(2-aminocyclohexyl)-3-(o-tolylmethyl)-5-(2-phenylsulfanylacetyl)-6,7-dihydro-4H-imidazo[4,5-c]pyridine-6-carboxamide CAS Name: N-(2-aminocyclohexyl)-3-[(2-methylphenyl)methyl]-5-[1-oxo-2-(phenylthio)ethyl]-6,7-dihydro-4H-imidazo[4,5-c]pyridine-6-carboxamide IUPAC Name: N-(2-aminocyclohexyl)-3-[(2-methylphenyl)methyl]-5-(2-phenylsulfanylacetyl)-6,7-dihydro-4H-imidazo[4,5-c]pyridine-6-carboxamide Traditional Name: N-(2-aminocyclohexyl)-3-(2-methylbenzyl)-5-[2-(phenylthio)acetyl]-6,7-dihydro-4H-imidazo[4,5-c]pyridine-6-carboxamide Formula: C29H35N5O2S MolecularWeight: 517.6855

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2C=NC3=C2CN(C(C3)C(=O)NC4CCCCC4N)C(=O)CSC5=CC=CC=C5

Isomeric SMILES

CC1=CC=CC=C1CN2C=NC3=C2CN(C(C3)C(=O)NC4CCCCC4N)C(=O)CSC5=CC=CC=C5

InChI

InChI=1S/C29H35N5O2S/c1-20-9-5-6-10-21(20)16-33-19-31-25-15-26(29(36)32-24-14-8-7-13-23(24)30)34(17-27(25)33)28(35)18-37-22-11-3-2-4-12-22/h2-6,9-12,19,23-24,26H,7-8,13-18,30H2,1H3,(H,32,36)