2-[4-(4-ethanoylphenyl)sulfonylpiperazin-1-yl]-6-fluoranyl-benzenecarbonitrile

Systemtic Name: 2-[4-(4-ethanoylphenyl)sulfonylpiperazin-1-yl]-6-fluoranyl-benzenecarbonitrile Openeye Name: 2-[4-(4-acetylphenyl)sulfonylpiperazin-1-yl]-6-fluoro-benzonitrile CAS Name: 2-[4-(4-acetylphenyl)sulfonyl-1-piperazinyl]-6-fluorobenzonitrile IUPAC Name: 2-[4-(4-acetylphenyl)sulfonylpiperazin-1-yl]-6-fluorobenzonitrile Traditional Name: 2-[4-(4-acetylphenyl)sulfonylpiperazino]-6-fluoro-benzonitrile Formula: C19H18FN3O3S MolecularWeight: 387.427923

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H18FN3O3S/c1-14(24)15-5-7-16(8-6-15)27(25,26)23-11-9-22(10-12-23)19-4-2-3-18(20)17(19)13-21/h2-8H,9-12H2,1H3