N-(3-acetamidophenyl)-2-(3-cyclohexylimidazo[4,5-b]pyridin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(3-acetamidophenyl)-2-(3-cyclohexylimidazo[4,5-b]pyridin-2-yl)sulfanyl-ethanamide Openeye Name: N-(3-acetamidophenyl)-2-(3-cyclohexylimidazo[4,5-b]pyridin-2-yl)sulfanyl-acetamide CAS Name: N-(3-acetamidophenyl)-2-[(3-cyclohexyl-2-imidazo[4,5-b]pyridinyl)thio]acetamide IUPAC Name: N-(3-acetamidophenyl)-2-(3-cyclohexylimidazo[4,5-b]pyridin-2-yl)sulfanylacetamide Traditional Name: N-(3-acetamidophenyl)-2-[(3-cyclohexylimidazo[4,5-b]pyridin-2-yl)thio]acetamide Formula: C22H25N5O2S MolecularWeight: 423.5312

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=CC=C1)NC(=O)CSC2=NC3=C(N2C4CCCCC4)N=CC=C3

Isomeric SMILES

CC(=O)NC1=CC(=CC=C1)NC(=O)CSC2=NC3=C(N2C4CCCCC4)N=CC=C3

InChI

InChI=1S/C22H25N5O2S/c1-15(28)24-16-7-5-8-17(13-16)25-20(29)14-30-22-26-19-11-6-12-23-21(19)27(22)18-9-3-2-4-10-18/h5-8,11-13,18H,2-4,9-10,14H2,1H3,(H,24,28)(H,25,29)