N-[4-[2-[2-(trifluoromethyl)quinazolin-4-yl]sulfanylethanoyl]phenyl]propanamide

Systemtic Name: N-[4-[2-[2-(trifluoromethyl)quinazolin-4-yl]sulfanylethanoyl]phenyl]propanamide Openeye Name: N-[4-[2-[2-(trifluoromethyl)quinazolin-4-yl]sulfanylacetyl]phenyl]propanamide CAS Name: N-[4-[1-oxo-2-[[2-(trifluoromethyl)-4-quinazolinyl]thio]ethyl]phenyl]propanamide IUPAC Name: N-[4-[2-[2-(trifluoromethyl)quinazolin-4-yl]sulfanylacetyl]phenyl]propanamide Traditional Name: N-[4-[2-[[2-(trifluoromethyl)quinazolin-4-yl]thio]acetyl]phenyl]propionamide Formula: C20H16F3N3O2S MolecularWeight: 419.42015

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC=C(C=C1)C(=O)CSC2=NC(=NC3=CC=CC=C32)C(F)(F)F

Isomeric SMILES

CCC(=O)NC1=CC=C(C=C1)C(=O)CSC2=NC(=NC3=CC=CC=C32)C(F)(F)F

InChI

InChI=1S/C20H16F3N3O2S/c1-2-17(28)24-13-9-7-12(8-10-13)16(27)11-29-18-14-5-3-4-6-15(14)25-19(26-18)20(21,22)23/h3-10H,2,11H2,1H3,(H,24,28)