N-(3-phenylpropyl)-4-[4-(trifluoromethyloxy)phenyl]sulfonyl-piperazine-1-carboxamide

Systemtic Name: N-(3-phenylpropyl)-4-[4-(trifluoromethyloxy)phenyl]sulfonyl-piperazine-1-carboxamide Openeye Name: N-(3-phenylpropyl)-4-[4-(trifluoromethoxy)phenyl]sulfonyl-piperazine-1-carboxamide CAS Name: N-(3-phenylpropyl)-4-[4-(trifluoromethoxy)phenyl]sulfonyl-1-piperazinecarboxamide IUPAC Name: N-(3-phenylpropyl)-4-[4-(trifluoromethoxy)phenyl]sulfonylpiperazine-1-carboxamide Traditional Name: N-(3-phenylpropyl)-4-[4-(trifluoromethoxy)phenyl]sulfonyl-piperazine-1-carboxamide Formula: C21H24F3N3O4S MolecularWeight: 471.49317

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)NCCCC2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)OC(F)(F)F

Isomeric SMILES

C1CN(CCN1C(=O)NCCCC2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)OC(F)(F)F

InChI

InChI=1S/C21H24F3N3O4S/c22-21(23,24)31-18-8-10-19(11-9-18)32(29,30)27-15-13-26(14-16-27)20(28)25-12-4-7-17-5-2-1-3-6-17/h1-3,5-6,8-11H,4,7,12-16H2,(H,25,28)