N-butyl-N-[(3-cyano-4-phenyl-phenyl)methyl]-3-methyl-2-(trifluoromethylsulfonylamino)butanamide

Systemtic Name: N-butyl-N-[(3-cyano-4-phenyl-phenyl)methyl]-3-methyl-2-(trifluoromethylsulfonylamino)butanamide Openeye Name: N-butyl-N-[(3-cyano-4-phenyl-phenyl)methyl]-3-methyl-2-(trifluoromethylsulfonylamino)butanamide CAS Name: N-butyl-N-[(3-cyano-4-phenylphenyl)methyl]-3-methyl-2-(trifluoromethylsulfonylamino)butanamide IUPAC Name: N-butyl-N-[(3-cyano-4-phenylphenyl)methyl]-3-methyl-2-(trifluoromethylsulfonylamino)butanamide Traditional Name: N-butyl-N-(3-cyano-4-phenyl-benzyl)-3-methyl-2-(triflylamino)butyramide Formula: C24H28F3N3O3S MolecularWeight: 495.55763

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC1=CC(=C(C=C1)C2=CC=CC=C2)C#N)C(=O)C(C(C)C)NS(=O)(=O)C(F)(F)F

Isomeric SMILES

CCCCN(CC1=CC(=C(C=C1)C2=CC=CC=C2)C#N)C(=O)C(C(C)C)NS(=O)(=O)C(F)(F)F

InChI

InChI=1S/C24H28F3N3O3S/c1-4-5-13-30(23(31)22(17(2)3)29-34(32,33)24(25,26)27)16-18-11-12-21(20(14-18)15-28)19-9-7-6-8-10-19/h6-12,14,17,22,29H,4-5,13,16H2,1-3H3