2-(3-cyano-6-methoxy-quinolin-2-yl)sulfanyl-N-(4-pyrrolidin-1-ylphenyl)ethanamide

Systemtic Name: 2-(3-cyano-6-methoxy-quinolin-2-yl)sulfanyl-N-(4-pyrrolidin-1-ylphenyl)ethanamide Openeye Name: 2-[(3-cyano-6-methoxy-2-quinolyl)sulfanyl]-N-(4-pyrrolidin-1-ylphenyl)acetamide CAS Name: 2-[(3-cyano-6-methoxy-2-quinolinyl)thio]-N-[4-(1-pyrrolidinyl)phenyl]acetamide IUPAC Name: 2-(3-cyano-6-methoxyquinolin-2-yl)sulfanyl-N-(4-pyrrolidin-1-ylphenyl)acetamide Traditional Name: 2-[(3-cyano-6-methoxy-2-quinolyl)thio]-N-(4-pyrrolidinophenyl)acetamide Formula: C23H22N4O2S MolecularWeight: 418.51138

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N=C(C(=C2)C#N)SCC(=O)NC3=CC=C(C=C3)N4CCCC4

Isomeric SMILES

COC1=CC2=C(C=C1)N=C(C(=C2)C#N)SCC(=O)NC3=CC=C(C=C3)N4CCCC4

InChI

InChI=1S/C23H22N4O2S/c1-29-20-8-9-21-16(13-20)12-17(14-24)23(26-21)30-15-22(28)25-18-4-6-19(7-5-18)27-10-2-3-11-27/h4-9,12-13H,2-3,10-11,15H2,1H3,(H,25,28)