1-(1-ethyl-2,5-dimethyl-pyrrol-3-yl)-2-[2-(trifluoromethyl)quinazolin-4-yl]sulfanyl-ethanone

Systemtic Name: 1-(1-ethyl-2,5-dimethyl-pyrrol-3-yl)-2-[2-(trifluoromethyl)quinazolin-4-yl]sulfanyl-ethanone Openeye Name: 1-(1-ethyl-2,5-dimethyl-pyrrol-3-yl)-2-[2-(trifluoromethyl)quinazolin-4-yl]sulfanyl-ethanone CAS Name: 1-(1-ethyl-2,5-dimethyl-3-pyrrolyl)-2-[[2-(trifluoromethyl)-4-quinazolinyl]thio]ethanone IUPAC Name: 1-(1-ethyl-2,5-dimethylpyrrol-3-yl)-2-[2-(trifluoromethyl)quinazolin-4-yl]sulfanylethanone Traditional Name: 1-(1-ethyl-2,5-dimethyl-pyrrol-3-yl)-2-[[2-(trifluoromethyl)quinazolin-4-yl]thio]ethanone Formula: C19H18F3N3OS MolecularWeight: 393.42593

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CC(=C1C)C(=O)CSC2=NC(=NC3=CC=CC=C32)C(F)(F)F)C

Isomeric SMILES

CCN1C(=CC(=C1C)C(=O)CSC2=NC(=NC3=CC=CC=C32)C(F)(F)F)C

InChI

InChI=1S/C19H18F3N3OS/c1-4-25-11(2)9-14(12(25)3)16(26)10-27-17-13-7-5-6-8-15(13)23-18(24-17)19(20,21)22/h5-9H,4,10H2,1-3H3