N-(3-chloranyl-4-cyano-phenyl)-2-(4-methylquinolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(3-chloranyl-4-cyano-phenyl)-2-(4-methylquinolin-2-yl)sulfanyl-ethanamide Openeye Name: N-(3-chloro-4-cyano-phenyl)-2-[(4-methyl-2-quinolyl)sulfanyl]acetamide CAS Name: N-(3-chloro-4-cyanophenyl)-2-[(4-methyl-2-quinolinyl)thio]acetamide IUPAC Name: N-(3-chloro-4-cyanophenyl)-2-(4-methylquinolin-2-yl)sulfanylacetamide Traditional Name: N-(3-chloro-4-cyano-phenyl)-2-[(4-methyl-2-quinolyl)thio]acetamide Formula: C19H14ClN3OS MolecularWeight: 367.85196

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=CC=CC=C12)SCC(=O)NC3=CC(=C(C=C3)C#N)Cl

Isomeric SMILES

CC1=CC(=NC2=CC=CC=C12)SCC(=O)NC3=CC(=C(C=C3)C#N)Cl

InChI

InChI=1S/C19H14ClN3OS/c1-12-8-19(23-17-5-3-2-4-15(12)17)25-11-18(24)22-14-7-6-13(10-21)16(20)9-14/h2-9H,11H2,1H3,(H,22,24)