1-[4-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]sulfonylphenyl]sulfonylazepane

Systemtic Name: 1-[4-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]sulfonylphenyl]sulfonylazepane Openeye Name: 1-[4-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]sulfonylphenyl]sulfonylazepane CAS Name: 1-[4-[[4-[3-(trifluoromethyl)phenyl]-1-piperazinyl]sulfonyl]phenyl]sulfonylazepane IUPAC Name: 1-[4-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]sulfonylphenyl]sulfonylazepane Traditional Name: 1-[4-[4-[3-(trifluoromethyl)phenyl]piperazino]sulfonylphenyl]sulfonylazepane Formula: C23H28F3N3O4S2 MolecularWeight: 531.61133

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCN(CC3)C4=CC=CC(=C4)C(F)(F)F

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCN(CC3)C4=CC=CC(=C4)C(F)(F)F

InChI

InChI=1S/C23H28F3N3O4S2/c24-23(25,26)19-6-5-7-20(18-19)27-14-16-29(17-15-27)35(32,33)22-10-8-21(9-11-22)34(30,31)28-12-3-1-2-4-13-28/h5-11,18H,1-4,12-17H2