(2S)-N-(2-ethoxyphenyl)-2-[4-[4-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]propanamide

Systemtic Name: (2S)-N-(2-ethoxyphenyl)-2-[4-[4-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]propanamide Openeye Name: (2S)-N-(2-ethoxyphenyl)-2-[4-[4-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]propanamide CAS Name: (2S)-N-(2-ethoxyphenyl)-2-[4-[4-(trifluoromethyl)phenyl]sulfonyl-1-piperazinyl]propanamide IUPAC Name: (2S)-N-(2-ethoxyphenyl)-2-[4-[4-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]propanamide Traditional Name: (2S)-N-o-phenetyl-2-[4-[4-(trifluoromethyl)phenyl]sulfonylpiperazino]propionamide Formula: C22H26F3N3O4S MolecularWeight: 485.51975

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1NC(=O)C(C)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C(F)(F)F

Isomeric SMILES

CCOC1=CC=CC=C1NC(=O)[C@H](C)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C22H26F3N3O4S/c1-3-32-20-7-5-4-6-19(20)26-21(29)16(2)27-12-14-28(15-13-27)33(30,31)18-10-8-17(9-11-18)22(23,24)25/h4-11,16H,3,12-15H2,1-2H3,(H,26,29)/t16-/m0/s1