3-fluoranyl-4-[[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 3-fluoranyl-4-[[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methyl]benzenecarbonitrile Openeye Name: 3-fluoro-4-[[4-(p-tolylsulfonyl)piperazin-1-yl]methyl]benzonitrile CAS Name: 3-fluoro-4-[[4-(4-methylphenyl)sulfonyl-1-piperazinyl]methyl]benzonitrile IUPAC Name: 3-fluoro-4-[[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methyl]benzonitrile Traditional Name: 3-fluoro-4-[(4-tosylpiperazino)methyl]benzonitrile Formula: C19H20FN3O2S MolecularWeight: 373.444403

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=C(C=C(C=C3)C#N)F

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=C(C=C(C=C3)C#N)F

InChI

InChI=1S/C19H20FN3O2S/c1-15-2-6-18(7-3-15)26(24,25)23-10-8-22(9-11-23)14-17-5-4-16(13-21)12-19(17)20/h2-7,12H,8-11,14H2,1H3