N-oxidanidyl-4-[(4-propan-2-ylphenyl)sulfonyl-[[4-(trifluoromethyl)phenyl]methyl]amino]butanamide

Systemtic Name: N-oxidanidyl-4-[(4-propan-2-ylphenyl)sulfonyl-[[4-(trifluoromethyl)phenyl]methyl]amino]butanamide Openeye Name: 4-[(4-isopropylphenyl)sulfonyl-[[4-(trifluoromethyl)phenyl]methyl]amino]-N-oxido-butanamide CAS Name: N-oxido-4-[(4-propan-2-ylphenyl)sulfonyl-[[4-(trifluoromethyl)phenyl]methyl]amino]butanamide IUPAC Name: N-oxido-4-[(4-propan-2-ylphenyl)sulfonyl-[[4-(trifluoromethyl)phenyl]methyl]amino]butanamide Traditional Name: N-oxido-4-[p-cumenylsulfonyl-[4-(trifluoromethyl)benzyl]amino]butyramide Formula: C21H24F3N2O4S- MolecularWeight: 457.48647

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)S(=O)(=O)N(CCCC(=O)N[O-])CC2=CC=C(C=C2)C(F)(F)F

Isomeric SMILES

CC(C)C1=CC=C(C=C1)S(=O)(=O)N(CCCC(=O)N[O-])CC2=CC=C(C=C2)C(F)(F)F

InChI

InChI=1S/C21H24F3N2O4S/c1-15(2)17-7-11-19(12-8-17)31(29,30)26(13-3-4-20(27)25-28)14-16-5-9-18(10-6-16)21(22,23)24/h5-12,15H,3-4,13-14H2,1-2H3,(H-,25,27,28)/q-1