3-fluoranyl-4-[[(1-methylsulfonylpiperidin-4-yl)amino]methyl]benzenecarbonitrile

Systemtic Name: 3-fluoranyl-4-[[(1-methylsulfonylpiperidin-4-yl)amino]methyl]benzenecarbonitrile Openeye Name: 3-fluoro-4-[[(1-methylsulfonyl-4-piperidyl)amino]methyl]benzonitrile CAS Name: 3-fluoro-4-[[(1-methylsulfonyl-4-piperidinyl)amino]methyl]benzonitrile IUPAC Name: 3-fluoro-4-[[(1-methylsulfonylpiperidin-4-yl)amino]methyl]benzonitrile Traditional Name: 3-fluoro-4-[[(1-mesyl-4-piperidyl)amino]methyl]benzonitrile Formula: C14H18FN3O2S MolecularWeight: 311.375023

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCC(CC1)NCC2=C(C=C(C=C2)C#N)F

Isomeric SMILES

CS(=O)(=O)N1CCC(CC1)NCC2=C(C=C(C=C2)C#N)F

InChI

InChI=1S/C14H18FN3O2S/c1-21(19,20)18-6-4-13(5-7-18)17-10-12-3-2-11(9-16)8-14(12)15/h2-3,8,13,17H,4-7,10H2,1H3