N-(1-adamantyl)-2-(4,8-dimethylquinolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(1-adamantyl)-2-(4,8-dimethylquinolin-2-yl)sulfanyl-ethanamide Openeye Name: N-(1-adamantyl)-2-[(4,8-dimethyl-2-quinolyl)sulfanyl]acetamide CAS Name: N-(1-adamantyl)-2-[(4,8-dimethyl-2-quinolinyl)thio]acetamide IUPAC Name: N-(1-adamantyl)-2-(4,8-dimethylquinolin-2-yl)sulfanylacetamide Traditional Name: N-(1-adamantyl)-2-[(4,8-dimethyl-2-quinolyl)thio]acetamide Formula: C23H28N2OS MolecularWeight: 380.54622

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N=C(C=C2C)SCC(=O)NC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CC1=CC=CC2=C1N=C(C=C2C)SCC(=O)NC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C23H28N2OS/c1-14-4-3-5-19-15(2)6-21(24-22(14)19)27-13-20(26)25-23-10-16-7-17(11-23)9-18(8-16)12-23/h3-6,16-18H,7-13H2,1-2H3,(H,25,26)