2-(4-tert-butylphenyl)sulfanyl-N-[2-pyrrolidin-1-yl-4-(trifluoromethyl)phenyl]ethanamide

Systemtic Name: 2-(4-tert-butylphenyl)sulfanyl-N-[2-pyrrolidin-1-yl-4-(trifluoromethyl)phenyl]ethanamide Openeye Name: 2-(4-tert-butylphenyl)sulfanyl-N-[2-pyrrolidin-1-yl-4-(trifluoromethyl)phenyl]acetamide CAS Name: 2-[(4-tert-butylphenyl)thio]-N-[2-(1-pyrrolidinyl)-4-(trifluoromethyl)phenyl]acetamide IUPAC Name: 2-(4-tert-butylphenyl)sulfanyl-N-[2-pyrrolidin-1-yl-4-(trifluoromethyl)phenyl]acetamide Traditional Name: 2-[(4-tert-butylphenyl)thio]-N-[2-pyrrolidino-4-(trifluoromethyl)phenyl]acetamide Formula: C23H27F3N2OS MolecularWeight: 436.53349

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)SCC(=O)NC2=C(C=C(C=C2)C(F)(F)F)N3CCCC3

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)SCC(=O)NC2=C(C=C(C=C2)C(F)(F)F)N3CCCC3

InChI

InChI=1S/C23H27F3N2OS/c1-22(2,3)16-6-9-18(10-7-16)30-15-21(29)27-19-11-8-17(23(24,25)26)14-20(19)28-12-4-5-13-28/h6-11,14H,4-5,12-13,15H2,1-3H3,(H,27,29)