N-[4-chloranyl-3-(trifluoromethyl)phenyl]-2-(4-thiophen-2-ylcarbonylpiperazin-1-yl)propanamide

Systemtic Name: N-[4-chloranyl-3-(trifluoromethyl)phenyl]-2-(4-thiophen-2-ylcarbonylpiperazin-1-yl)propanamide Openeye Name: N-[4-chloro-3-(trifluoromethyl)phenyl]-2-[4-(thiophene-2-carbonyl)piperazin-1-yl]propanamide CAS Name: N-[4-chloro-3-(trifluoromethyl)phenyl]-2-[4-[oxo(thiophen-2-yl)methyl]-1-piperazinyl]propanamide IUPAC Name: N-[4-chloro-3-(trifluoromethyl)phenyl]-2-[4-(thiophene-2-carbonyl)piperazin-1-yl]propanamide Traditional Name: N-[4-chloro-3-(trifluoromethyl)phenyl]-2-[4-(2-thenoyl)piperazino]propionamide Formula: C19H19ClF3N3O2S MolecularWeight: 445.88627

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC(=C(C=C1)Cl)C(F)(F)F)N2CCN(CC2)C(=O)C3=CC=CS3

Isomeric SMILES

CC(C(=O)NC1=CC(=C(C=C1)Cl)C(F)(F)F)N2CCN(CC2)C(=O)C3=CC=CS3

InChI

InChI=1S/C19H19ClF3N3O2S/c1-12(17(27)24-13-4-5-15(20)14(11-13)19(21,22)23)25-6-8-26(9-7-25)18(28)16-3-2-10-29-16/h2-5,10-12H,6-9H2,1H3,(H,24,27)