2-[4-oxidanylidene-2-[[1-propyl-6-(trifluoromethyl)benzimidazol-2-yl]sulfanylmethyl]quinazolin-3-yl]ethanamide

Systemtic Name: 2-[4-oxidanylidene-2-[[1-propyl-6-(trifluoromethyl)benzimidazol-2-yl]sulfanylmethyl]quinazolin-3-yl]ethanamide Openeye Name: 2-[4-oxo-2-[[1-propyl-6-(trifluoromethyl)benzimidazol-2-yl]sulfanylmethyl]quinazolin-3-yl]acetamide CAS Name: 2-[4-oxo-2-[[[1-propyl-6-(trifluoromethyl)-2-benzimidazolyl]thio]methyl]-3-quinazolinyl]acetamide IUPAC Name: 2-[4-oxo-2-[[1-propyl-6-(trifluoromethyl)benzimidazol-2-yl]sulfanylmethyl]quinazolin-3-yl]acetamide Traditional Name: 2-[4-keto-2-[[[1-propyl-6-(trifluoromethyl)benzimidazol-2-yl]thio]methyl]quinazolin-3-yl]acetamide Formula: C22H20F3N5O2S MolecularWeight: 475.48671

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=CC(=C2)C(F)(F)F)N=C1SCC3=NC4=CC=CC=C4C(=O)N3CC(=O)N

Isomeric SMILES

CCCN1C2=C(C=CC(=C2)C(F)(F)F)N=C1SCC3=NC4=CC=CC=C4C(=O)N3CC(=O)N

InChI

InChI=1S/C22H20F3N5O2S/c1-2-9-29-17-10-13(22(23,24)25)7-8-16(17)28-21(29)33-12-19-27-15-6-4-3-5-14(15)20(32)30(19)11-18(26)31/h3-8,10H,2,9,11-12H2,1H3,(H2,26,31)