2-[(3-cyano-6-methyl-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]-N-(4-ethanoylphenyl)ethanamide

Systemtic Name: 2-[(3-cyano-6-methyl-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]-N-(4-ethanoylphenyl)ethanamide Openeye Name: N-(4-acetylphenyl)-2-[(3-cyano-6-methyl-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]acetamide CAS Name: N-(4-acetylphenyl)-2-[(3-cyano-6-methyl-5,6,7,8-tetrahydroquinolin-2-yl)thio]acetamide IUPAC Name: N-(4-acetylphenyl)-2-[(3-cyano-6-methyl-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]acetamide Traditional Name: N-(4-acetylphenyl)-2-[(3-cyano-6-methyl-5,6,7,8-tetrahydroquinolin-2-yl)thio]acetamide Formula: C21H21N3O2S MolecularWeight: 379.47534

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)C=C(C(=N2)SCC(=O)NC3=CC=C(C=C3)C(=O)C)C#N

Isomeric SMILES

CC1CCC2=C(C1)C=C(C(=N2)SCC(=O)NC3=CC=C(C=C3)C(=O)C)C#N

InChI

InChI=1S/C21H21N3O2S/c1-13-3-8-19-16(9-13)10-17(11-22)21(24-19)27-12-20(26)23-18-6-4-15(5-7-18)14(2)25/h4-7,10,13H,3,8-9,12H2,1-2H3,(H,23,26)