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

Systemtic Name: 2-(3-cyano-7-methyl-quinolin-2-yl)sulfanyl-N-[(4-methoxyphenyl)methyl]ethanamide Openeye Name: 2-[(3-cyano-7-methyl-2-quinolyl)sulfanyl]-N-[(4-methoxyphenyl)methyl]acetamide CAS Name: 2-[(3-cyano-7-methyl-2-quinolinyl)thio]-N-[(4-methoxyphenyl)methyl]acetamide IUPAC Name: 2-(3-cyano-7-methylquinolin-2-yl)sulfanyl-N-[(4-methoxyphenyl)methyl]acetamide Traditional Name: 2-[(3-cyano-7-methyl-2-quinolyl)thio]-N-p-anisyl-acetamide Formula: C21H19N3O2S MolecularWeight: 377.45946

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C=C(C(=N2)SCC(=O)NCC3=CC=C(C=C3)OC)C#N

Isomeric SMILES

CC1=CC2=C(C=C1)C=C(C(=N2)SCC(=O)NCC3=CC=C(C=C3)OC)C#N

InChI

InChI=1S/C21H19N3O2S/c1-14-3-6-16-10-17(11-22)21(24-19(16)9-14)27-13-20(25)23-12-15-4-7-18(26-2)8-5-15/h3-10H,12-13H2,1-2H3,(H,23,25)