2-[[4-(3-methylquinolin-8-yl)sulfonylpiperazin-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 2-[[4-(3-methylquinolin-8-yl)sulfonylpiperazin-1-yl]methyl]benzenecarbonitrile Openeye Name: 2-[[4-[(3-methyl-8-quinolyl)sulfonyl]piperazin-1-yl]methyl]benzonitrile CAS Name: 2-[[4-[(3-methyl-8-quinolinyl)sulfonyl]-1-piperazinyl]methyl]benzonitrile IUPAC Name: 2-[[4-(3-methylquinolin-8-yl)sulfonylpiperazin-1-yl]methyl]benzonitrile Traditional Name: 2-[[4-[(3-methyl-8-quinolyl)sulfonyl]piperazino]methyl]benzonitrile Formula: C22H22N4O2S MolecularWeight: 406.50068

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C2C(=C1)C=CC=C2S(=O)(=O)N3CCN(CC3)CC4=CC=CC=C4C#N

Isomeric SMILES

CC1=CN=C2C(=C1)C=CC=C2S(=O)(=O)N3CCN(CC3)CC4=CC=CC=C4C#N

InChI

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