Molecule ID: 3216369

IUPAC Name: N-[2-(cyclohexylamino)-2-oxo-1-thiophen-2-ylethyl]-2,2,2-trifluoro-N-(4-methylphenyl)acetamide

Description: The molecule is a trifluoroacetamide, a tertiary carboxamide, a secondary carboxamide and a member of thiophenes. It derives from an alpha-amino acid.

SMILES: Cc1ccc(N(C(=O)C(F)(F)F)C(C(O)=NC2CCCCC2)c2cccs2)cc1

SELFIES: [C][C][=C][C][=C][Branch2][Ring2][#Branch1][N][Branch1][=N][C][=Branch1][C][=O][C][Branch1][C][F][Branch1][C][F][F][C][Branch1][=C][C][Branch1][C][O][=N][C][C][C][C][C][C][Ring1][=Branch1][C][=C][C][=C][S][Ring1][Branch1][C][=C][Ring2][Ring1][N]

InChI: InChI=1S/C21H23F3N2O2S/c1-14-9-11-16(12-10-14)26(20(28)21(22,23)24)18(17-8-5-13-29-17)19(27)25-15-6-3-2-4-7-15/h5,8-13,15,18H,2-4,6-7H2,1H3,(H,25,27)

Molecular Properties:
- Polar Surface Area: 77.6 Ų
- LogP: 5.3