N-(5-chloranyl-2-methoxy-phenyl)-2-(3-cyano-8-methyl-quinolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(5-chloranyl-2-methoxy-phenyl)-2-(3-cyano-8-methyl-quinolin-2-yl)sulfanyl-ethanamide Openeye Name: N-(5-chloro-2-methoxy-phenyl)-2-[(3-cyano-8-methyl-2-quinolyl)sulfanyl]acetamide CAS Name: N-(5-chloro-2-methoxyphenyl)-2-[(3-cyano-8-methyl-2-quinolinyl)thio]acetamide IUPAC Name: N-(5-chloro-2-methoxyphenyl)-2-(3-cyano-8-methylquinolin-2-yl)sulfanylacetamide Traditional Name: N-(5-chloro-2-methoxy-phenyl)-2-[(3-cyano-8-methyl-2-quinolyl)thio]acetamide Formula: C20H16ClN3O2S MolecularWeight: 397.87794

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N=C(C(=C2)C#N)SCC(=O)NC3=C(C=CC(=C3)Cl)OC

Isomeric SMILES

CC1=CC=CC2=C1N=C(C(=C2)C#N)SCC(=O)NC3=C(C=CC(=C3)Cl)OC

InChI

InChI=1S/C20H16ClN3O2S/c1-12-4-3-5-13-8-14(10-22)20(24-19(12)13)27-11-18(25)23-16-9-15(21)6-7-17(16)26-2/h3-9H,11H2,1-2H3,(H,23,25)