N-(2-methoxyquinolin-3-yl)-4-(2-methylsulfanylphenyl)piperazine-1-carboxamide

Systemtic Name: N-(2-methoxyquinolin-3-yl)-4-(2-methylsulfanylphenyl)piperazine-1-carboxamide Openeye Name: N-(2-methoxy-3-quinolyl)-4-(2-methylsulfanylphenyl)piperazine-1-carboxamide CAS Name: N-(2-methoxy-3-quinolinyl)-4-[2-(methylthio)phenyl]-1-piperazinecarboxamide IUPAC Name: N-(2-methoxyquinolin-3-yl)-4-(2-methylsulfanylphenyl)piperazine-1-carboxamide Traditional Name: N-(2-methoxy-3-quinolyl)-4-[2-(methylthio)phenyl]piperazine-1-carboxamide Formula: C22H24N4O2S MolecularWeight: 408.51656

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=NC2=CC=CC=C2C=C1NC(=O)N3CCN(CC3)C4=CC=CC=C4SC

Isomeric SMILES

COC1=NC2=CC=CC=C2C=C1NC(=O)N3CCN(CC3)C4=CC=CC=C4SC

InChI

InChI=1S/C22H24N4O2S/c1-28-21-18(15-16-7-3-4-8-17(16)23-21)24-22(27)26-13-11-25(12-14-26)19-9-5-6-10-20(19)29-2/h3-10,15H,11-14H2,1-2H3,(H,24,27)