N-(4-butylphenyl)-2-[[2-chloranyl-5-(trifluoromethyl)phenyl]-methylsulfonyl-amino]ethanamide

Systemtic Name: N-(4-butylphenyl)-2-[[2-chloranyl-5-(trifluoromethyl)phenyl]-methylsulfonyl-amino]ethanamide Openeye Name: N-(4-butylphenyl)-2-[2-chloro-N-methylsulfonyl-5-(trifluoromethyl)anilino]acetamide CAS Name: N-(4-butylphenyl)-2-[2-chloro-N-methylsulfonyl-5-(trifluoromethyl)anilino]acetamide IUPAC Name: N-(4-butylphenyl)-2-[2-chloro-N-methylsulfonyl-5-(trifluoromethyl)anilino]acetamide Traditional Name: N-(4-butylphenyl)-2-[2-chloro-N-mesyl-5-(trifluoromethyl)anilino]acetamide Formula: C20H22ClF3N2O3S MolecularWeight: 462.91349

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=O)CN(C2=C(C=CC(=C2)C(F)(F)F)Cl)S(=O)(=O)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=O)CN(C2=C(C=CC(=C2)C(F)(F)F)Cl)S(=O)(=O)C

InChI

InChI=1S/C20H22ClF3N2O3S/c1-3-4-5-14-6-9-16(10-7-14)25-19(27)13-26(30(2,28)29)18-12-15(20(22,23)24)8-11-17(18)21/h6-12H,3-5,13H2,1-2H3,(H,25,27)