1-[4-(5-nitrothiophen-2-yl)carbonylpiperazin-1-yl]-2-[4-(trifluoromethyl)phenyl]ethanone

Systemtic Name: 1-[4-(5-nitrothiophen-2-yl)carbonylpiperazin-1-yl]-2-[4-(trifluoromethyl)phenyl]ethanone Openeye Name: 1-[4-(5-nitrothiophene-2-carbonyl)piperazin-1-yl]-2-[4-(trifluoromethyl)phenyl]ethanone CAS Name: 1-[4-[(5-nitro-2-thiophenyl)-oxomethyl]-1-piperazinyl]-2-[4-(trifluoromethyl)phenyl]ethanone IUPAC Name: 1-[4-(5-nitrothiophene-2-carbonyl)piperazin-1-yl]-2-[4-(trifluoromethyl)phenyl]ethanone Traditional Name: 1-[4-(5-nitrothiophene-2-carbonyl)piperazino]-2-[4-(trifluoromethyl)phenyl]ethanone Formula: C18H16F3N3O4S MolecularWeight: 427.39755

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CC2=CC=C(C=C2)C(F)(F)F)C(=O)C3=CC=C(S3)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C(=O)CC2=CC=C(C=C2)C(F)(F)F)C(=O)C3=CC=C(S3)[N+](=O)[O-]

InChI

InChI=1S/C18H16F3N3O4S/c19-18(20,21)13-3-1-12(2-4-13)11-15(25)22-7-9-23(10-8-22)17(26)14-5-6-16(29-14)24(27)28/h1-6H,7-11H2