4-[[6-(4-methylpiperidin-1-yl)sulfonylquinolin-2-yl]amino]benzenecarbonitrile

Systemtic Name: 4-[[6-(4-methylpiperidin-1-yl)sulfonylquinolin-2-yl]amino]benzenecarbonitrile Openeye Name: 4-[[6-[(4-methyl-1-piperidyl)sulfonyl]-2-quinolyl]amino]benzonitrile CAS Name: 4-[[6-[(4-methyl-1-piperidinyl)sulfonyl]-2-quinolinyl]amino]benzonitrile IUPAC Name: 4-[[6-(4-methylpiperidin-1-yl)sulfonylquinolin-2-yl]amino]benzonitrile Traditional Name: 4-[[6-(4-methylpiperidino)sulfonyl-2-quinolyl]amino]benzonitrile Formula: C22H22N4O2S MolecularWeight: 406.50068

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)N=C(C=C3)NC4=CC=C(C=C4)C#N

Isomeric SMILES

CC1CCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)N=C(C=C3)NC4=CC=C(C=C4)C#N

InChI

InChI=1S/C22H22N4O2S/c1-16-10-12-26(13-11-16)29(27,28)20-7-8-21-18(14-20)4-9-22(25-21)24-19-5-2-17(15-23)3-6-19/h2-9,14,16H,10-13H2,1H3,(H,24,25)