1-(2,5-dimethyl-1-phenyl-pyrrol-3-yl)-2-[3-(trifluoromethyl)phenyl]sulfanyl-ethanone

Systemtic Name: 1-(2,5-dimethyl-1-phenyl-pyrrol-3-yl)-2-[3-(trifluoromethyl)phenyl]sulfanyl-ethanone Openeye Name: 1-(2,5-dimethyl-1-phenyl-pyrrol-3-yl)-2-[3-(trifluoromethyl)phenyl]sulfanyl-ethanone CAS Name: 1-(2,5-dimethyl-1-phenyl-3-pyrrolyl)-2-[[3-(trifluoromethyl)phenyl]thio]ethanone IUPAC Name: 1-(2,5-dimethyl-1-phenylpyrrol-3-yl)-2-[3-(trifluoromethyl)phenyl]sulfanylethanone Traditional Name: 1-(2,5-dimethyl-1-phenyl-pyrrol-3-yl)-2-[[3-(trifluoromethyl)phenyl]thio]ethanone Formula: C21H18F3NOS MolecularWeight: 389.43393

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=CC=C2)C)C(=O)CSC3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

CC1=CC(=C(N1C2=CC=CC=C2)C)C(=O)CSC3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C21H18F3NOS/c1-14-11-19(15(2)25(14)17-8-4-3-5-9-17)20(26)13-27-18-10-6-7-16(12-18)21(22,23)24/h3-12H,13H2,1-2H3