N-(2-prop-2-enylsulfanylphenyl)-2-[2-(trifluoromethyl)quinazolin-4-yl]sulfanyl-ethanamide

Systemtic Name: N-(2-prop-2-enylsulfanylphenyl)-2-[2-(trifluoromethyl)quinazolin-4-yl]sulfanyl-ethanamide Openeye Name: N-(2-allylsulfanylphenyl)-2-[2-(trifluoromethyl)quinazolin-4-yl]sulfanyl-acetamide CAS Name: N-[2-(prop-2-enylthio)phenyl]-2-[[2-(trifluoromethyl)-4-quinazolinyl]thio]acetamide IUPAC Name: N-(2-prop-2-enylsulfanylphenyl)-2-[2-(trifluoromethyl)quinazolin-4-yl]sulfanylacetamide Traditional Name: N-[2-(allylthio)phenyl]-2-[[2-(trifluoromethyl)quinazolin-4-yl]thio]acetamide Formula: C20H16F3N3OS2 MolecularWeight: 435.48575

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Descriptors Computed from Structure

Canonical SMILES:

C=CCSC1=CC=CC=C1NC(=O)CSC2=NC(=NC3=CC=CC=C32)C(F)(F)F

Isomeric SMILES

C=CCSC1=CC=CC=C1NC(=O)CSC2=NC(=NC3=CC=CC=C32)C(F)(F)F

InChI

InChI=1S/C20H16F3N3OS2/c1-2-11-28-16-10-6-5-9-15(16)24-17(27)12-29-18-13-7-3-4-8-14(13)25-19(26-18)20(21,22)23/h2-10H,1,11-12H2,(H,24,27)