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

Systemtic Name: 3-[4-(4-bromophenyl)sulfonylpiperazin-1-yl]-N-[3-(trifluoromethyl)phenyl]propanamide Openeye Name: 3-[4-(4-bromophenyl)sulfonylpiperazin-1-yl]-N-[3-(trifluoromethyl)phenyl]propanamide CAS Name: 3-[4-(4-bromophenyl)sulfonyl-1-piperazinyl]-N-[3-(trifluoromethyl)phenyl]propanamide IUPAC Name: 3-[4-(4-bromophenyl)sulfonylpiperazin-1-yl]-N-[3-(trifluoromethyl)phenyl]propanamide Traditional Name: 3-(4-brosylpiperazino)-N-[3-(trifluoromethyl)phenyl]propionamide Formula: C20H21BrF3N3O3S MolecularWeight: 520.36325

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCC(=O)NC2=CC=CC(=C2)C(F)(F)F)S(=O)(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

C1CN(CCN1CCC(=O)NC2=CC=CC(=C2)C(F)(F)F)S(=O)(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C20H21BrF3N3O3S/c21-16-4-6-18(7-5-16)31(29,30)27-12-10-26(11-13-27)9-8-19(28)25-17-3-1-2-15(14-17)20(22,23)24/h1-7,14H,8-13H2,(H,25,28)