2-(4-tert-butylphenyl)sulfanyl-N-[2-(4-methylpiperazin-1-yl)-5-(trifluoromethyl)phenyl]ethanamide

Systemtic Name: 2-(4-tert-butylphenyl)sulfanyl-N-[2-(4-methylpiperazin-1-yl)-5-(trifluoromethyl)phenyl]ethanamide Openeye Name: 2-(4-tert-butylphenyl)sulfanyl-N-[2-(4-methylpiperazin-1-yl)-5-(trifluoromethyl)phenyl]acetamide CAS Name: 2-[(4-tert-butylphenyl)thio]-N-[2-(4-methyl-1-piperazinyl)-5-(trifluoromethyl)phenyl]acetamide IUPAC Name: 2-(4-tert-butylphenyl)sulfanyl-N-[2-(4-methylpiperazin-1-yl)-5-(trifluoromethyl)phenyl]acetamide Traditional Name: 2-[(4-tert-butylphenyl)thio]-N-[2-(4-methylpiperazino)-5-(trifluoromethyl)phenyl]acetamide Formula: C24H30F3N3OS MolecularWeight: 465.57471

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)SCC(=O)NC2=C(C=CC(=C2)C(F)(F)F)N3CCN(CC3)C

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)SCC(=O)NC2=C(C=CC(=C2)C(F)(F)F)N3CCN(CC3)C

InChI

InChI=1S/C24H30F3N3OS/c1-23(2,3)17-5-8-19(9-6-17)32-16-22(31)28-20-15-18(24(25,26)27)7-10-21(20)30-13-11-29(4)12-14-30/h5-10,15H,11-14,16H2,1-4H3,(H,28,31)