2-[2-[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]-2-oxidanylidene-ethoxy]benzenecarbonitrile

Systemtic Name: 2-[2-[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]-2-oxidanylidene-ethoxy]benzenecarbonitrile Openeye Name: 2-[2-[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]-2-oxo-ethoxy]benzonitrile CAS Name: 2-[2-[4-(3-fluorophenyl)sulfonyl-1-piperazinyl]-2-oxoethoxy]benzonitrile IUPAC Name: 2-[2-[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]-2-oxoethoxy]benzonitrile Traditional Name: 2-[2-[4-(3-fluorophenyl)sulfonylpiperazino]-2-keto-ethoxy]benzonitrile Formula: C19H18FN3O4S MolecularWeight: 403.427323

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)COC2=CC=CC=C2C#N)S(=O)(=O)C3=CC=CC(=C3)F

Isomeric SMILES

C1CN(CCN1C(=O)COC2=CC=CC=C2C#N)S(=O)(=O)C3=CC=CC(=C3)F

InChI

InChI=1S/C19H18FN3O4S/c20-16-5-3-6-17(12-16)28(25,26)23-10-8-22(9-11-23)19(24)14-27-18-7-2-1-4-15(18)13-21/h1-7,12H,8-11,14H2