N-(5-chloranyl-2-methyl-phenyl)-2-[(7,8-dimethyl-4-oxidanylidene-1H-quinolin-2-yl)methylsulfanyl]ethanamide

Systemtic Name: N-(5-chloranyl-2-methyl-phenyl)-2-[(7,8-dimethyl-4-oxidanylidene-1H-quinolin-2-yl)methylsulfanyl]ethanamide Openeye Name: N-(5-chloro-2-methyl-phenyl)-2-[(7,8-dimethyl-4-oxo-1H-quinolin-2-yl)methylsulfanyl]acetamide CAS Name: N-(5-chloro-2-methylphenyl)-2-[(7,8-dimethyl-4-oxo-1H-quinolin-2-yl)methylthio]acetamide IUPAC Name: N-(5-chloro-2-methylphenyl)-2-[(7,8-dimethyl-4-oxo-1H-quinolin-2-yl)methylsulfanyl]acetamide Traditional Name: N-(5-chloro-2-methyl-phenyl)-2-[(4-keto-7,8-dimethyl-1H-quinolin-2-yl)methylthio]acetamide Formula: C21H21ClN2O2S MolecularWeight: 400.92164

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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