2-fluoranyl-6-[4-(2-naphthalen-2-ylsulfanylethanoyl)piperazin-1-yl]benzenecarbonitrile

Systemtic Name: 2-fluoranyl-6-[4-(2-naphthalen-2-ylsulfanylethanoyl)piperazin-1-yl]benzenecarbonitrile Openeye Name: 2-fluoro-6-[4-[2-(2-naphthylsulfanyl)acetyl]piperazin-1-yl]benzonitrile CAS Name: 2-fluoro-6-[4-[2-(2-naphthalenylthio)-1-oxoethyl]-1-piperazinyl]benzonitrile IUPAC Name: 2-fluoro-6-[4-(2-naphthalen-2-ylsulfanylacetyl)piperazin-1-yl]benzonitrile Traditional Name: 2-fluoro-6-[4-[2-(2-naphthylthio)acetyl]piperazino]benzonitrile Formula: C23H20FN3OS MolecularWeight: 405.487803

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C(=CC=C2)F)C#N)C(=O)CSC3=CC4=CC=CC=C4C=C3

Isomeric SMILES

C1CN(CCN1C2=C(C(=CC=C2)F)C#N)C(=O)CSC3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C23H20FN3OS/c24-21-6-3-7-22(20(21)15-25)26-10-12-27(13-11-26)23(28)16-29-19-9-8-17-4-1-2-5-18(17)14-19/h1-9,14H,10-13,16H2