2-(7-chloranyl-3-cyano-6-methyl-quinolin-2-yl)sulfanyl-N-[(4-methoxyphenyl)methyl]ethanamide

Systemtic Name: 2-(7-chloranyl-3-cyano-6-methyl-quinolin-2-yl)sulfanyl-N-[(4-methoxyphenyl)methyl]ethanamide Openeye Name: 2-[(7-chloro-3-cyano-6-methyl-2-quinolyl)sulfanyl]-N-[(4-methoxyphenyl)methyl]acetamide CAS Name: 2-[(7-chloro-3-cyano-6-methyl-2-quinolinyl)thio]-N-[(4-methoxyphenyl)methyl]acetamide IUPAC Name: 2-(7-chloro-3-cyano-6-methylquinolin-2-yl)sulfanyl-N-[(4-methoxyphenyl)methyl]acetamide Traditional Name: 2-[(7-chloro-3-cyano-6-methyl-2-quinolyl)thio]-N-p-anisyl-acetamide Formula: C21H18ClN3O2S MolecularWeight: 411.90452

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C=C(C(=N2)SCC(=O)NCC3=CC=C(C=C3)OC)C#N)Cl

Isomeric SMILES

CC1=C(C=C2C(=C1)C=C(C(=N2)SCC(=O)NCC3=CC=C(C=C3)OC)C#N)Cl

InChI

InChI=1S/C21H18ClN3O2S/c1-13-7-15-8-16(10-23)21(25-19(15)9-18(13)22)28-12-20(26)24-11-14-3-5-17(27-2)6-4-14/h3-9H,11-12H2,1-2H3,(H,24,26)