2-fluoranyl-6-[4-(3-methylquinolin-8-yl)sulfonylpiperazin-1-yl]benzenecarbonitrile

Systemtic Name: 2-fluoranyl-6-[4-(3-methylquinolin-8-yl)sulfonylpiperazin-1-yl]benzenecarbonitrile Openeye Name: 2-fluoro-6-[4-[(3-methyl-8-quinolyl)sulfonyl]piperazin-1-yl]benzonitrile CAS Name: 2-fluoro-6-[4-[(3-methyl-8-quinolinyl)sulfonyl]-1-piperazinyl]benzonitrile IUPAC Name: 2-fluoro-6-[4-(3-methylquinolin-8-yl)sulfonylpiperazin-1-yl]benzonitrile Traditional Name: 2-fluoro-6-[4-[(3-methyl-8-quinolyl)sulfonyl]piperazino]benzonitrile Formula: C21H19FN4O2S MolecularWeight: 410.464563

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C2C(=C1)C=CC=C2S(=O)(=O)N3CCN(CC3)C4=C(C(=CC=C4)F)C#N

Isomeric SMILES

CC1=CN=C2C(=C1)C=CC=C2S(=O)(=O)N3CCN(CC3)C4=C(C(=CC=C4)F)C#N

InChI

InChI=1S/C21H19FN4O2S/c1-15-12-16-4-2-7-20(21(16)24-14-15)29(27,28)26-10-8-25(9-11-26)19-6-3-5-18(22)17(19)13-23/h2-7,12,14H,8-11H2,1H3