4,5-dihydrobenzo[g][1]benzothiol-2-yl-[4-(2-fluorophenyl)sulfonylpiperazin-1-yl]methanone

Systemtic Name: 4,5-dihydrobenzo[g][1]benzothiol-2-yl-[4-(2-fluorophenyl)sulfonylpiperazin-1-yl]methanone Openeye Name: 4,5-dihydrobenzo[g]benzothiophen-2-yl-[4-(2-fluorophenyl)sulfonylpiperazin-1-yl]methanone CAS Name: 4,5-dihydrobenzo[g][1]benzothiol-2-yl-[4-(2-fluorophenyl)sulfonyl-1-piperazinyl]methanone IUPAC Name: 4,5-dihydrobenzo[g][1]benzothiol-2-yl-[4-(2-fluorophenyl)sulfonylpiperazin-1-yl]methanone Traditional Name: 4,5-dihydrobenzo[g]benzothiophen-2-yl-[4-(2-fluorophenyl)sulfonylpiperazino]methanone Formula: C23H21FN2O3S2 MolecularWeight: 456.552843

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C3=CC=CC=C31)SC(=C2)C(=O)N4CCN(CC4)S(=O)(=O)C5=CC=CC=C5F

Isomeric SMILES

C1CC2=C(C3=CC=CC=C31)SC(=C2)C(=O)N4CCN(CC4)S(=O)(=O)C5=CC=CC=C5F

InChI

InChI=1S/C23H21FN2O3S2/c24-19-7-3-4-8-21(19)31(28,29)26-13-11-25(12-14-26)23(27)20-15-17-10-9-16-5-1-2-6-18(16)22(17)30-20/h1-8,15H,9-14H2