2-(3-cyano-7-methoxy-quinolin-2-yl)sulfanyl-N-(4-pyrrolidin-1-ylphenyl)ethanamide

Systemtic Name: 2-(3-cyano-7-methoxy-quinolin-2-yl)sulfanyl-N-(4-pyrrolidin-1-ylphenyl)ethanamide Openeye Name: 2-[(3-cyano-7-methoxy-2-quinolyl)sulfanyl]-N-(4-pyrrolidin-1-ylphenyl)acetamide CAS Name: 2-[(3-cyano-7-methoxy-2-quinolinyl)thio]-N-[4-(1-pyrrolidinyl)phenyl]acetamide IUPAC Name: 2-(3-cyano-7-methoxyquinolin-2-yl)sulfanyl-N-(4-pyrrolidin-1-ylphenyl)acetamide Traditional Name: 2-[(3-cyano-7-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)C=C(C(=N2)SCC(=O)NC3=CC=C(C=C3)N4CCCC4)C#N

Isomeric SMILES

COC1=CC2=C(C=C1)C=C(C(=N2)SCC(=O)NC3=CC=C(C=C3)N4CCCC4)C#N

InChI

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