(5-nitrothiophen-3-yl)-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]methanone

Systemtic Name: (5-nitrothiophen-3-yl)-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]methanone Openeye Name: (5-nitro-3-thienyl)-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]methanone CAS Name: (5-nitro-3-thiophenyl)-[4-[3-(trifluoromethyl)phenyl]-1-piperazinyl]methanone IUPAC Name: (5-nitrothiophen-3-yl)-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]methanone Traditional Name: (5-nitro-3-thienyl)-[4-[3-(trifluoromethyl)phenyl]piperazino]methanone Formula: C16H14F3N3O3S MolecularWeight: 385.36087

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H14F3N3O3S/c17-16(18,19)12-2-1-3-13(9-12)20-4-6-21(7-5-20)15(23)11-8-14(22(24)25)26-10-11/h1-3,8-10H,4-7H2