(5-nitrothiophen-2-yl)-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]methanone

Systemtic Name: (5-nitrothiophen-2-yl)-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]methanone Openeye Name: (5-nitro-2-thienyl)-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]methanone CAS Name: (5-nitro-2-thiophenyl)-[4-[3-(trifluoromethyl)phenyl]-1-piperazinyl]methanone IUPAC Name: (5-nitrothiophen-2-yl)-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]methanone Traditional Name: (5-nitro-2-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=CC=C(S3)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C2=CC=CC(=C2)C(F)(F)F)C(=O)C3=CC=C(S3)[N+](=O)[O-]

InChI

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