N-(2-cyano-3-methyl-butan-2-yl)-2-[4-[3-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]ethanamide

Systemtic Name: N-(2-cyano-3-methyl-butan-2-yl)-2-[4-[3-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]ethanamide Openeye Name: N-(1-cyano-1,2-dimethyl-propyl)-2-[4-[3-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]acetamide CAS Name: N-(2-cyano-3-methylbutan-2-yl)-2-[4-[3-(trifluoromethyl)phenyl]sulfonyl-1-piperazinyl]acetamide IUPAC Name: N-(2-cyano-3-methylbutan-2-yl)-2-[4-[3-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]acetamide Traditional Name: N-(1-cyano-1,2-dimethyl-propyl)-2-[4-[3-(trifluoromethyl)phenyl]sulfonylpiperazino]acetamide Formula: C19H25F3N4O3S MolecularWeight: 446.48701

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C)(C#N)NC(=O)CN1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(F)(F)F

Isomeric SMILES

CC(C)C(C)(C#N)NC(=O)CN1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(F)(F)F

InChI

InChI=1S/C19H25F3N4O3S/c1-14(2)18(3,13-23)24-17(27)12-25-7-9-26(10-8-25)30(28,29)16-6-4-5-15(11-16)19(20,21)22/h4-6,11,14H,7-10,12H2,1-3H3,(H,24,27)