3-[4-(2-fluorophenyl)piperazin-1-yl]-1,1-bis(oxidanylidene)-2-propyl-3,4-dihydro-2H-thiochromen-4-ol

Systemtic Name: 3-[4-(2-fluorophenyl)piperazin-1-yl]-1,1-bis(oxidanylidene)-2-propyl-3,4-dihydro-2H-thiochromen-4-ol Openeye Name: 3-[4-(2-fluorophenyl)piperazin-1-yl]-1,1-dioxo-2-propyl-3,4-dihydro-2H-thiochromen-4-ol CAS Name: 3-[4-(2-fluorophenyl)-1-piperazinyl]-1,1-dioxo-2-propyl-3,4-dihydro-2H-1-benzothiopyran-4-ol IUPAC Name: 3-[4-(2-fluorophenyl)piperazin-1-yl]-1,1-dioxo-2-propyl-3,4-dihydro-2H-thiochromen-4-ol Traditional Name: 3-[4-(2-fluorophenyl)piperazino]-1,1-diketo-2-propyl-3,4-dihydro-2H-thiochromen-4-ol Formula: C22H27FN2O3S MolecularWeight: 418.524783

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1C(C(C2=CC=CC=C2S1(=O)=O)O)N3CCN(CC3)C4=CC=CC=C4F

Isomeric SMILES

CCCC1C(C(C2=CC=CC=C2S1(=O)=O)O)N3CCN(CC3)C4=CC=CC=C4F

InChI

InChI=1S/C22H27FN2O3S/c1-2-7-20-21(22(26)16-8-3-6-11-19(16)29(20,27)28)25-14-12-24(13-15-25)18-10-5-4-9-17(18)23/h3-6,8-11,20-22,26H,2,7,12-15H2,1H3