5-(azepan-1-ylcarbonyl)-2-chloranyl-N-prop-2-enyl-N-[3-(trifluoromethyl)phenyl]benzenesulfonamide

Systemtic Name: 5-(azepan-1-ylcarbonyl)-2-chloranyl-N-prop-2-enyl-N-[3-(trifluoromethyl)phenyl]benzenesulfonamide Openeye Name: N-allyl-5-(azepane-1-carbonyl)-2-chloro-N-[3-(trifluoromethyl)phenyl]benzenesulfonamide CAS Name: 5-[1-azepanyl(oxo)methyl]-2-chloro-N-prop-2-enyl-N-[3-(trifluoromethyl)phenyl]benzenesulfonamide IUPAC Name: 5-(azepane-1-carbonyl)-2-chloro-N-prop-2-enyl-N-[3-(trifluoromethyl)phenyl]benzenesulfonamide Traditional Name: N-allyl-5-(azepane-1-carbonyl)-2-chloro-N-[3-(trifluoromethyl)phenyl]benzenesulfonamide Formula: C23H24ClF3N2O3S MolecularWeight: 500.96147

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN(C1=CC=CC(=C1)C(F)(F)F)S(=O)(=O)C2=C(C=CC(=C2)C(=O)N3CCCCCC3)Cl

Isomeric SMILES

C=CCN(C1=CC=CC(=C1)C(F)(F)F)S(=O)(=O)C2=C(C=CC(=C2)C(=O)N3CCCCCC3)Cl

InChI

InChI=1S/C23H24ClF3N2O3S/c1-2-12-29(19-9-7-8-18(16-19)23(25,26)27)33(31,32)21-15-17(10-11-20(21)24)22(30)28-13-5-3-4-6-14-28/h2,7-11,15-16H,1,3-6,12-14H2