[4-(2-nitrophenyl)piperazin-1-yl]-[2-(trifluoromethylsulfanyl)phenyl]methanone

Systemtic Name: [4-(2-nitrophenyl)piperazin-1-yl]-[2-(trifluoromethylsulfanyl)phenyl]methanone Openeye Name: [4-(2-nitrophenyl)piperazin-1-yl]-[2-(trifluoromethylsulfanyl)phenyl]methanone CAS Name: [4-(2-nitrophenyl)-1-piperazinyl]-[2-(trifluoromethylthio)phenyl]methanone IUPAC Name: [4-(2-nitrophenyl)piperazin-1-yl]-[2-(trifluoromethylsulfanyl)phenyl]methanone Traditional Name: [4-(2-nitrophenyl)piperazino]-[2-(trifluoromethylthio)phenyl]methanone Formula: C18H16F3N3O3S MolecularWeight: 411.39815

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2[N+](=O)[O-])C(=O)C3=CC=CC=C3SC(F)(F)F

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2[N+](=O)[O-])C(=O)C3=CC=CC=C3SC(F)(F)F

InChI

InChI=1S/C18H16F3N3O3S/c19-18(20,21)28-16-8-4-1-5-13(16)17(25)23-11-9-22(10-12-23)14-6-2-3-7-15(14)24(26)27/h1-8H,9-12H2