2-[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperazin-1-yl]-6-fluoranyl-benzenecarbonitrile

Systemtic Name: 2-[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperazin-1-yl]-6-fluoranyl-benzenecarbonitrile Openeye Name: 2-fluoro-6-(4-indan-5-ylsulfonylpiperazin-1-yl)benzonitrile CAS Name: 2-[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)-1-piperazinyl]-6-fluorobenzonitrile IUPAC Name: 2-[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperazin-1-yl]-6-fluorobenzonitrile Traditional Name: 2-fluoro-6-(4-indan-5-ylsulfonylpiperazino)benzonitrile Formula: C20H20FN3O2S MolecularWeight: 385.455103

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)C=C(C=C2)S(=O)(=O)N3CCN(CC3)C4=C(C(=CC=C4)F)C#N

Isomeric SMILES

C1CC2=C(C1)C=C(C=C2)S(=O)(=O)N3CCN(CC3)C4=C(C(=CC=C4)F)C#N

InChI

InChI=1S/C20H20FN3O2S/c21-19-5-2-6-20(18(19)14-22)23-9-11-24(12-10-23)27(25,26)17-8-7-15-3-1-4-16(15)13-17/h2,5-8,13H,1,3-4,9-12H2