2-[(6-chloranyl-2-oxidanylidene-4-phenyl-1H-quinolin-3-yl)sulfanyl]-N-(3-methylbutyl)ethanamide

Systemtic Name: 2-[(6-chloranyl-2-oxidanylidene-4-phenyl-1H-quinolin-3-yl)sulfanyl]-N-(3-methylbutyl)ethanamide Openeye Name: 2-[(6-chloro-2-oxo-4-phenyl-1H-quinolin-3-yl)sulfanyl]-N-isopentyl-acetamide CAS Name: 2-[(6-chloro-2-oxo-4-phenyl-1H-quinolin-3-yl)thio]-N-(3-methylbutyl)acetamide IUPAC Name: 2-[(6-chloro-2-oxo-4-phenyl-1H-quinolin-3-yl)sulfanyl]-N-(3-methylbutyl)acetamide Traditional Name: 2-[(6-chloro-2-keto-4-phenyl-1H-quinolin-3-yl)thio]-N-isoamyl-acetamide Formula: C22H23ClN2O2S MolecularWeight: 414.94822

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)CSC1=C(C2=C(C=CC(=C2)Cl)NC1=O)C3=CC=CC=C3

Isomeric SMILES

CC(C)CCNC(=O)CSC1=C(C2=C(C=CC(=C2)Cl)NC1=O)C3=CC=CC=C3

InChI

InChI=1S/C22H23ClN2O2S/c1-14(2)10-11-24-19(26)13-28-21-20(15-6-4-3-5-7-15)17-12-16(23)8-9-18(17)25-22(21)27/h3-9,12,14H,10-11,13H2,1-2H3,(H,24,26)(H,25,27)