2-[4-[2-(4-fluorophenyl)ethanoyl]piperazin-1-yl]sulfonylbenzenecarbonitrile

Systemtic Name: 2-[4-[2-(4-fluorophenyl)ethanoyl]piperazin-1-yl]sulfonylbenzenecarbonitrile Openeye Name: 2-[4-[2-(4-fluorophenyl)acetyl]piperazin-1-yl]sulfonylbenzonitrile CAS Name: 2-[[4-[2-(4-fluorophenyl)-1-oxoethyl]-1-piperazinyl]sulfonyl]benzonitrile IUPAC Name: 2-[4-[2-(4-fluorophenyl)acetyl]piperazin-1-yl]sulfonylbenzonitrile Traditional Name: 2-[4-[2-(4-fluorophenyl)acetyl]piperazino]sulfonylbenzonitrile Formula: C19H18FN3O3S MolecularWeight: 387.427923

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CC2=CC=C(C=C2)F)S(=O)(=O)C3=CC=CC=C3C#N

Isomeric SMILES

C1CN(CCN1C(=O)CC2=CC=C(C=C2)F)S(=O)(=O)C3=CC=CC=C3C#N

InChI

InChI=1S/C19H18FN3O3S/c20-17-7-5-15(6-8-17)13-19(24)22-9-11-23(12-10-22)27(25,26)18-4-2-1-3-16(18)14-21/h1-8H,9-13H2