2-[[2-pyrrolidin-1-yl-5-(trifluoromethyl)phenyl]amino]-1-(4-thiophen-2-ylcarbonylpiperazin-1-yl)ethanone

Systemtic Name: 2-[[2-pyrrolidin-1-yl-5-(trifluoromethyl)phenyl]amino]-1-(4-thiophen-2-ylcarbonylpiperazin-1-yl)ethanone Openeye Name: 2-[2-pyrrolidin-1-yl-5-(trifluoromethyl)anilino]-1-[4-(thiophene-2-carbonyl)piperazin-1-yl]ethanone CAS Name: 1-[4-[oxo(thiophen-2-yl)methyl]-1-piperazinyl]-2-[2-(1-pyrrolidinyl)-5-(trifluoromethyl)anilino]ethanone IUPAC Name: 2-[2-pyrrolidin-1-yl-5-(trifluoromethyl)anilino]-1-[4-(thiophene-2-carbonyl)piperazin-1-yl]ethanone Traditional Name: 2-[2-pyrrolidino-5-(trifluoromethyl)anilino]-1-[4-(2-thenoyl)piperazino]ethanone Formula: C22H25F3N4O2S MolecularWeight: 466.51971

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=C(C=C2)C(F)(F)F)NCC(=O)N3CCN(CC3)C(=O)C4=CC=CS4

Isomeric SMILES

C1CCN(C1)C2=C(C=C(C=C2)C(F)(F)F)NCC(=O)N3CCN(CC3)C(=O)C4=CC=CS4

InChI

InChI=1S/C22H25F3N4O2S/c23-22(24,25)16-5-6-18(27-7-1-2-8-27)17(14-16)26-15-20(30)28-9-11-29(12-10-28)21(31)19-4-3-13-32-19/h3-6,13-14,26H,1-2,7-12,15H2