2-[3-[4-(4-fluorophenyl)piperazin-1-yl]propyl]-2H-thiochromene 1,1-dioxide

Systemtic Name: 2-[3-[4-(4-fluorophenyl)piperazin-1-yl]propyl]-2H-thiochromene 1,1-dioxide Openeye Name: 2-[3-[4-(4-fluorophenyl)piperazin-1-yl]propyl]-2H-thiochromene 1,1-dioxide CAS Name: 2-[3-[4-(4-fluorophenyl)-1-piperazinyl]propyl]-2H-1-benzothiopyran 1,1-dioxide IUPAC Name: 2-[3-[4-(4-fluorophenyl)piperazin-1-yl]propyl]-2H-thiochromene 1,1-dioxide Traditional Name: 2-[3-[4-(4-fluorophenyl)piperazino]propyl]-2H-thiochromene 1,1-dioxide Formula: C22H25FN2O2S MolecularWeight: 400.509503

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCC2C=CC3=CC=CC=C3S2(=O)=O)C4=CC=C(C=C4)F

Isomeric SMILES

C1CN(CCN1CCCC2C=CC3=CC=CC=C3S2(=O)=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C22H25FN2O2S/c23-19-8-10-20(11-9-19)25-16-14-24(15-17-25)13-3-5-21-12-7-18-4-1-2-6-22(18)28(21,26)27/h1-2,4,6-12,21H,3,5,13-17H2