2-(3-butyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-[2-chloranyl-6-(trifluoromethyl)phenyl]ethanamide

Systemtic Name: 2-(3-butyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-[2-chloranyl-6-(trifluoromethyl)phenyl]ethanamide Openeye Name: 2-(3-butyl-4-oxo-quinazolin-2-yl)sulfanyl-N-[2-chloro-6-(trifluoromethyl)phenyl]acetamide CAS Name: 2-[(3-butyl-4-oxo-2-quinazolinyl)thio]-N-[2-chloro-6-(trifluoromethyl)phenyl]acetamide IUPAC Name: 2-(3-butyl-4-oxoquinazolin-2-yl)sulfanyl-N-[2-chloro-6-(trifluoromethyl)phenyl]acetamide Traditional Name: 2-[(3-butyl-4-keto-quinazolin-2-yl)thio]-N-[2-chloro-6-(trifluoromethyl)phenyl]acetamide Formula: C21H19ClF3N3O2S MolecularWeight: 469.90767

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC3=C(C=CC=C3Cl)C(F)(F)F

Isomeric SMILES

CCCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC3=C(C=CC=C3Cl)C(F)(F)F

InChI

InChI=1S/C21H19ClF3N3O2S/c1-2-3-11-28-19(30)13-7-4-5-10-16(13)26-20(28)31-12-17(29)27-18-14(21(23,24)25)8-6-9-15(18)22/h4-10H,2-3,11-12H2,1H3,(H,27,29)