2-[3-(3-methoxypropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-[4-(trifluoromethyl)phenyl]ethanamide

Systemtic Name: 2-[3-(3-methoxypropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-[4-(trifluoromethyl)phenyl]ethanamide Openeye Name: 2-[3-(3-methoxypropyl)-4-oxo-quinazolin-2-yl]sulfanyl-N-[4-(trifluoromethyl)phenyl]acetamide CAS Name: 2-[[3-(3-methoxypropyl)-4-oxo-2-quinazolinyl]thio]-N-[4-(trifluoromethyl)phenyl]acetamide IUPAC Name: 2-[3-(3-methoxypropyl)-4-oxoquinazolin-2-yl]sulfanyl-N-[4-(trifluoromethyl)phenyl]acetamide Traditional Name: 2-[[4-keto-3-(3-methoxypropyl)quinazolin-2-yl]thio]-N-[4-(trifluoromethyl)phenyl]acetamide Formula: C21H20F3N3O3S MolecularWeight: 451.46201

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Descriptors Computed from Structure

Canonical SMILES:

COCCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC3=CC=C(C=C3)C(F)(F)F

Isomeric SMILES

COCCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC3=CC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C21H20F3N3O3S/c1-30-12-4-11-27-19(29)16-5-2-3-6-17(16)26-20(27)31-13-18(28)25-15-9-7-14(8-10-15)21(22,23)24/h2-3,5-10H,4,11-13H2,1H3,(H,25,28)