N-[3-(4-chlorophenyl)sulfonyl-4,5-dimethyl-1-(phenylmethyl)pyrrol-2-yl]-2,2,2-tris(fluoranyl)ethanamide

Systemtic Name: N-[3-(4-chlorophenyl)sulfonyl-4,5-dimethyl-1-(phenylmethyl)pyrrol-2-yl]-2,2,2-tris(fluoranyl)ethanamide Openeye Name: N-[1-benzyl-3-(4-chlorophenyl)sulfonyl-4,5-dimethyl-pyrrol-2-yl]-2,2,2-trifluoro-acetamide CAS Name: N-[3-(4-chlorophenyl)sulfonyl-4,5-dimethyl-1-(phenylmethyl)-2-pyrrolyl]-2,2,2-trifluoroacetamide IUPAC Name: N-[1-benzyl-3-(4-chlorophenyl)sulfonyl-4,5-dimethylpyrrol-2-yl]-2,2,2-trifluoroacetamide Traditional Name: N-[1-benzyl-3-(4-chlorophenyl)sulfonyl-4,5-dimethyl-pyrrol-2-yl]-2,2,2-trifluoro-acetamide Formula: C21H18ClF3N2O3S MolecularWeight: 470.89243

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=C1S(=O)(=O)C2=CC=C(C=C2)Cl)NC(=O)C(F)(F)F)CC3=CC=CC=C3)C

Isomeric SMILES

CC1=C(N(C(=C1S(=O)(=O)C2=CC=C(C=C2)Cl)NC(=O)C(F)(F)F)CC3=CC=CC=C3)C

InChI

InChI=1S/C21H18ClF3N2O3S/c1-13-14(2)27(12-15-6-4-3-5-7-15)19(26-20(28)21(23,24)25)18(13)31(29,30)17-10-8-16(22)9-11-17/h3-11H,12H2,1-2H3,(H,26,28)