N-[2-(3-methylphenoxy)ethyl]-4-[3-(trifluoromethyl)phenyl]sulfonyl-piperazine-1-carboxamide

Systemtic Name: N-[2-(3-methylphenoxy)ethyl]-4-[3-(trifluoromethyl)phenyl]sulfonyl-piperazine-1-carboxamide Openeye Name: N-[2-(3-methylphenoxy)ethyl]-4-[3-(trifluoromethyl)phenyl]sulfonyl-piperazine-1-carboxamide CAS Name: N-[2-(3-methylphenoxy)ethyl]-4-[3-(trifluoromethyl)phenyl]sulfonyl-1-piperazinecarboxamide IUPAC Name: N-[2-(3-methylphenoxy)ethyl]-4-[3-(trifluoromethyl)phenyl]sulfonylpiperazine-1-carboxamide Traditional Name: N-[2-(3-methylphenoxy)ethyl]-4-[3-(trifluoromethyl)phenyl]sulfonyl-piperazine-1-carboxamide Formula: C21H24F3N3O4S MolecularWeight: 471.49317

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCCNC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

CC1=CC(=CC=C1)OCCNC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C21H24F3N3O4S/c1-16-4-2-6-18(14-16)31-13-8-25-20(28)26-9-11-27(12-10-26)32(29,30)19-7-3-5-17(15-19)21(22,23)24/h2-7,14-15H,8-13H2,1H3,(H,25,28)