2-(7-chloranyl-4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanyl-N-[4-(trifluoromethyloxy)phenyl]ethanamide

Systemtic Name: 2-(7-chloranyl-4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanyl-N-[4-(trifluoromethyloxy)phenyl]ethanamide Openeye Name: 2-(3-allyl-7-chloro-4-oxo-quinazolin-2-yl)sulfanyl-N-[4-(trifluoromethoxy)phenyl]acetamide CAS Name: 2-[(7-chloro-4-oxo-3-prop-2-enyl-2-quinazolinyl)thio]-N-[4-(trifluoromethoxy)phenyl]acetamide IUPAC Name: 2-(7-chloro-4-oxo-3-prop-2-enylquinazolin-2-yl)sulfanyl-N-[4-(trifluoromethoxy)phenyl]acetamide Traditional Name: 2-[(3-allyl-7-chloro-4-keto-quinazolin-2-yl)thio]-N-[4-(trifluoromethoxy)phenyl]acetamide Formula: C20H15ClF3N3O3S MolecularWeight: 469.86461

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=O)C2=C(C=C(C=C2)Cl)N=C1SCC(=O)NC3=CC=C(C=C3)OC(F)(F)F

Isomeric SMILES

C=CCN1C(=O)C2=C(C=C(C=C2)Cl)N=C1SCC(=O)NC3=CC=C(C=C3)OC(F)(F)F

InChI

InChI=1S/C20H15ClF3N3O3S/c1-2-9-27-18(29)15-8-3-12(21)10-16(15)26-19(27)31-11-17(28)25-13-4-6-14(7-5-13)30-20(22,23)24/h2-8,10H,1,9,11H2,(H,25,28)