N-[3-oxidanylidene-1-thiophen-2-yl-3-[4-[2-(trifluoromethyl)phenyl]carbonylpiperazin-1-yl]propyl]ethanamide

Systemtic Name: N-[3-oxidanylidene-1-thiophen-2-yl-3-[4-[2-(trifluoromethyl)phenyl]carbonylpiperazin-1-yl]propyl]ethanamide Openeye Name: N-[3-oxo-1-(2-thienyl)-3-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]propyl]acetamide CAS Name: N-[3-oxo-3-[4-[oxo-[2-(trifluoromethyl)phenyl]methyl]-1-piperazinyl]-1-thiophen-2-ylpropyl]acetamide IUPAC Name: N-[3-oxo-1-thiophen-2-yl-3-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]propyl]acetamide Traditional Name: N-[3-keto-1-(2-thienyl)-3-[4-[2-(trifluoromethyl)benzoyl]piperazino]propyl]acetamide Formula: C21H22F3N3O3S MolecularWeight: 453.47789

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CC(=O)N1CCN(CC1)C(=O)C2=CC=CC=C2C(F)(F)F)C3=CC=CS3

Isomeric SMILES

CC(=O)NC(CC(=O)N1CCN(CC1)C(=O)C2=CC=CC=C2C(F)(F)F)C3=CC=CS3

InChI

InChI=1S/C21H22F3N3O3S/c1-14(28)25-17(18-7-4-12-31-18)13-19(29)26-8-10-27(11-9-26)20(30)15-5-2-3-6-16(15)21(22,23)24/h2-7,12,17H,8-11,13H2,1H3,(H,25,28)