4-phenyl-N-(3-pyrrol-1-ylthiophen-2-yl)-4-[3-(trifluoromethyl)phenyl]piperazin-4-ium-1-carboxamide

Systemtic Name: 4-phenyl-N-(3-pyrrol-1-ylthiophen-2-yl)-4-[3-(trifluoromethyl)phenyl]piperazin-4-ium-1-carboxamide Openeye Name: 4-phenyl-N-(3-pyrrol-1-yl-2-thienyl)-4-[3-(trifluoromethyl)phenyl]piperazin-4-ium-1-carboxamide CAS Name: 4-phenyl-N-[3-(1-pyrrolyl)-2-thiophenyl]-4-[3-(trifluoromethyl)phenyl]-1-piperazin-4-iumcarboxamide IUPAC Name: 4-phenyl-N-(3-pyrrol-1-ylthiophen-2-yl)-4-[3-(trifluoromethyl)phenyl]piperazin-4-ium-1-carboxamide Traditional Name: 4-phenyl-N-(3-pyrrol-1-yl-2-thienyl)-4-[3-(trifluoromethyl)phenyl]piperazin-4-ium-1-carboxamide Formula: C26H24F3N4OS+ MolecularWeight: 497.55517

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Descriptors Computed from Structure

Canonical SMILES:

C1C[N+](CCN1C(=O)NC2=C(C=CS2)N3C=CC=C3)(C4=CC=CC=C4)C5=CC=CC(=C5)C(F)(F)F

Isomeric SMILES

C1C[N+](CCN1C(=O)NC2=C(C=CS2)N3C=CC=C3)(C4=CC=CC=C4)C5=CC=CC(=C5)C(F)(F)F

InChI

InChI=1S/C26H23F3N4OS/c27-26(28,29)20-7-6-10-22(19-20)33(21-8-2-1-3-9-21)16-14-32(15-17-33)25(34)30-24-23(11-18-35-24)31-12-4-5-13-31/h1-13,18-19H,14-17H2/p+1