2-(7-chloranyl-1-methyl-2-oxidanylidene-quinolin-4-yl)sulfanyl-N-[(4-ethylphenyl)methyl]ethanamide

Systemtic Name: 2-(7-chloranyl-1-methyl-2-oxidanylidene-quinolin-4-yl)sulfanyl-N-[(4-ethylphenyl)methyl]ethanamide Openeye Name: 2-[(7-chloro-1-methyl-2-oxo-4-quinolyl)sulfanyl]-N-[(4-ethylphenyl)methyl]acetamide CAS Name: 2-[(7-chloro-1-methyl-2-oxo-4-quinolinyl)thio]-N-[(4-ethylphenyl)methyl]acetamide IUPAC Name: 2-(7-chloro-1-methyl-2-oxoquinolin-4-yl)sulfanyl-N-[(4-ethylphenyl)methyl]acetamide Traditional Name: 2-[(7-chloro-2-keto-1-methyl-4-quinolyl)thio]-N-(4-ethylbenzyl)acetamide Formula: C21H21ClN2O2S MolecularWeight: 400.92164

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)CNC(=O)CSC2=CC(=O)N(C3=C2C=CC(=C3)Cl)C

Isomeric SMILES

CCC1=CC=C(C=C1)CNC(=O)CSC2=CC(=O)N(C3=C2C=CC(=C3)Cl)C

InChI

InChI=1S/C21H21ClN2O2S/c1-3-14-4-6-15(7-5-14)12-23-20(25)13-27-19-11-21(26)24(2)18-10-16(22)8-9-17(18)19/h4-11H,3,12-13H2,1-2H3,(H,23,25)