N-(3-chloranyl-4-fluoranyl-phenyl)-2-[(7,8-dimethyl-4-oxidanylidene-1H-quinolin-2-yl)methylsulfanyl]ethanamide

Systemtic Name: N-(3-chloranyl-4-fluoranyl-phenyl)-2-[(7,8-dimethyl-4-oxidanylidene-1H-quinolin-2-yl)methylsulfanyl]ethanamide Openeye Name: N-(3-chloro-4-fluoro-phenyl)-2-[(7,8-dimethyl-4-oxo-1H-quinolin-2-yl)methylsulfanyl]acetamide CAS Name: N-(3-chloro-4-fluorophenyl)-2-[(7,8-dimethyl-4-oxo-1H-quinolin-2-yl)methylthio]acetamide IUPAC Name: N-(3-chloro-4-fluorophenyl)-2-[(7,8-dimethyl-4-oxo-1H-quinolin-2-yl)methylsulfanyl]acetamide Traditional Name: N-(3-chloro-4-fluoro-phenyl)-2-[(4-keto-7,8-dimethyl-1H-quinolin-2-yl)methylthio]acetamide Formula: C20H18ClFN2O2S MolecularWeight: 404.885523

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)C(=O)C=C(N2)CSCC(=O)NC3=CC(=C(C=C3)F)Cl)C

Isomeric SMILES

CC1=C(C2=C(C=C1)C(=O)C=C(N2)CSCC(=O)NC3=CC(=C(C=C3)F)Cl)C

InChI

InChI=1S/C20H18ClFN2O2S/c1-11-3-5-15-18(25)8-14(24-20(15)12(11)2)9-27-10-19(26)23-13-4-6-17(22)16(21)7-13/h3-8H,9-10H2,1-2H3,(H,23,26)(H,24,25)