N-(3-phenoxypropyl)-4-[4-(trifluoromethyl)phenyl]sulfonyl-piperazine-1-carboxamide

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)NCCCOC2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)C(F)(F)F

Isomeric SMILES

C1CN(CCN1C(=O)NCCCOC2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)C(F)(F)F

InChI

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