[1-(6-bromanylquinolin-4-yl)piperidin-4-yl]-(2-methylsulfanylphenyl)methanone

Systemtic Name: [1-(6-bromanylquinolin-4-yl)piperidin-4-yl]-(2-methylsulfanylphenyl)methanone Openeye Name: [1-(6-bromo-4-quinolyl)-4-piperidyl]-(2-methylsulfanylphenyl)methanone CAS Name: [1-(6-bromo-4-quinolinyl)-4-piperidinyl]-[2-(methylthio)phenyl]methanone IUPAC Name: [1-(6-bromoquinolin-4-yl)piperidin-4-yl]-(2-methylsulfanylphenyl)methanone Traditional Name: [1-(6-bromo-4-quinolyl)-4-piperidyl]-[2-(methylthio)phenyl]methanone Formula: C22H21BrN2OS MolecularWeight: 441.38394

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC=C1C(=O)C2CCN(CC2)C3=C4C=C(C=CC4=NC=C3)Br

Isomeric SMILES

CSC1=CC=CC=C1C(=O)C2CCN(CC2)C3=C4C=C(C=CC4=NC=C3)Br

InChI

InChI=1S/C22H21BrN2OS/c1-27-21-5-3-2-4-17(21)22(26)15-9-12-25(13-10-15)20-8-11-24-19-7-6-16(23)14-18(19)20/h2-8,11,14-15H,9-10,12-13H2,1H3