N-(4-ethylphenyl)-2-[4-[3-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]propanamide

Systemtic Name: N-(4-ethylphenyl)-2-[4-[3-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]propanamide Openeye Name: N-(4-ethylphenyl)-2-[4-[3-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]propanamide CAS Name: N-(4-ethylphenyl)-2-[4-[3-(trifluoromethyl)phenyl]sulfonyl-1-piperazinyl]propanamide IUPAC Name: N-(4-ethylphenyl)-2-[4-[3-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]propanamide Traditional Name: N-(4-ethylphenyl)-2-[4-[3-(trifluoromethyl)phenyl]sulfonylpiperazino]propionamide Formula: C22H26F3N3O3S MolecularWeight: 469.52035

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)C(C)N2CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)C(C)N2CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C22H26F3N3O3S/c1-3-17-7-9-19(10-8-17)26-21(29)16(2)27-11-13-28(14-12-27)32(30,31)20-6-4-5-18(15-20)22(23,24)25/h4-10,15-16H,3,11-14H2,1-2H3,(H,26,29)