[4-(azepan-1-ylsulfonyl)piperazin-1-yl]-[4-(trifluoromethylsulfanyl)phenyl]methanone

Systemtic Name: [4-(azepan-1-ylsulfonyl)piperazin-1-yl]-[4-(trifluoromethylsulfanyl)phenyl]methanone Openeye Name: [4-(azepan-1-ylsulfonyl)piperazin-1-yl]-[4-(trifluoromethylsulfanyl)phenyl]methanone CAS Name: [4-(1-azepanylsulfonyl)-1-piperazinyl]-[4-(trifluoromethylthio)phenyl]methanone IUPAC Name: [4-(azepan-1-ylsulfonyl)piperazin-1-yl]-[4-(trifluoromethylsulfanyl)phenyl]methanone Traditional Name: [4-(azepan-1-ylsulfonyl)piperazino]-[4-(trifluoromethylthio)phenyl]methanone Formula: C18H24F3N3O3S2 MolecularWeight: 451.52667

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)SC(F)(F)F

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)SC(F)(F)F

InChI

InChI=1S/C18H24F3N3O3S2/c19-18(20,21)28-16-7-5-15(6-8-16)17(25)22-11-13-24(14-12-22)29(26,27)23-9-3-1-2-4-10-23/h5-8H,1-4,9-14H2