[4-(4-nitrophenyl)sulfonylpiperazin-1-yl]-[4-(trifluoromethylsulfanyl)phenyl]methanone

Systemtic Name: [4-(4-nitrophenyl)sulfonylpiperazin-1-yl]-[4-(trifluoromethylsulfanyl)phenyl]methanone Openeye Name: [4-(4-nitrophenyl)sulfonylpiperazin-1-yl]-[4-(trifluoromethylsulfanyl)phenyl]methanone CAS Name: [4-(4-nitrophenyl)sulfonyl-1-piperazinyl]-[4-(trifluoromethylthio)phenyl]methanone IUPAC Name: [4-(4-nitrophenyl)sulfonylpiperazin-1-yl]-[4-(trifluoromethylsulfanyl)phenyl]methanone Traditional Name: (4-nosylpiperazino)-[4-(trifluoromethylthio)phenyl]methanone Formula: C18H16F3N3O5S2 MolecularWeight: 475.46195

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CC=C(C=C2)SC(F)(F)F)S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C(=O)C2=CC=C(C=C2)SC(F)(F)F)S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H16F3N3O5S2/c19-18(20,21)30-15-5-1-13(2-6-15)17(25)22-9-11-23(12-10-22)31(28,29)16-7-3-14(4-8-16)24(26)27/h1-8H,9-12H2