3-[4-(4-fluorophenyl)piperazin-1-yl]-6-methyl-thiochromen-4-one

Systemtic Name: 3-[4-(4-fluorophenyl)piperazin-1-yl]-6-methyl-thiochromen-4-one Openeye Name: 3-[4-(4-fluorophenyl)piperazin-1-yl]-6-methyl-thiochromen-4-one CAS Name: 3-[4-(4-fluorophenyl)-1-piperazinyl]-6-methyl-1-benzothiopyran-4-one IUPAC Name: 3-[4-(4-fluorophenyl)piperazin-1-yl]-6-methylthiochromen-4-one Traditional Name: 3-[4-(4-fluorophenyl)piperazino]-6-methyl-thiochromen-4-one Formula: C20H19FN2OS MolecularWeight: 354.441063

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)SC=C(C2=O)N3CCN(CC3)C4=CC=C(C=C4)F

Isomeric SMILES

CC1=CC2=C(C=C1)SC=C(C2=O)N3CCN(CC3)C4=CC=C(C=C4)F

InChI

InChI=1S/C20H19FN2OS/c1-14-2-7-19-17(12-14)20(24)18(13-25-19)23-10-8-22(9-11-23)16-5-3-15(21)4-6-16/h2-7,12-13H,8-11H2,1H3