[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]-(3-phenylthiophen-2-yl)methanone

Systemtic Name: [4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]-(3-phenylthiophen-2-yl)methanone Openeye Name: [4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]-(3-phenyl-2-thienyl)methanone CAS Name: [4-[2-nitro-4-(trifluoromethyl)phenyl]-1-piperazinyl]-(3-phenyl-2-thiophenyl)methanone IUPAC Name: [4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]-(3-phenylthiophen-2-yl)methanone Traditional Name: [4-[2-nitro-4-(trifluoromethyl)phenyl]piperazino]-(3-phenyl-2-thienyl)methanone Formula: C22H18F3N3O3S MolecularWeight: 461.45683

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-])C(=O)C3=C(C=CS3)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-])C(=O)C3=C(C=CS3)C4=CC=CC=C4

InChI

InChI=1S/C22H18F3N3O3S/c23-22(24,25)16-6-7-18(19(14-16)28(30)31)26-9-11-27(12-10-26)21(29)20-17(8-13-32-20)15-4-2-1-3-5-15/h1-8,13-14H,9-12H2