2-(3-butyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-ethyl-N-(4-fluorophenyl)ethanamide

Systemtic Name: 2-(3-butyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-ethyl-N-(4-fluorophenyl)ethanamide Openeye Name: 2-(3-butyl-4-oxo-quinazolin-2-yl)sulfanyl-N-ethyl-N-(4-fluorophenyl)acetamide CAS Name: 2-[(3-butyl-4-oxo-2-quinazolinyl)thio]-N-ethyl-N-(4-fluorophenyl)acetamide IUPAC Name: 2-(3-butyl-4-oxoquinazolin-2-yl)sulfanyl-N-ethyl-N-(4-fluorophenyl)acetamide Traditional Name: 2-[(3-butyl-4-keto-quinazolin-2-yl)thio]-N-ethyl-N-(4-fluorophenyl)acetamide Formula: C22H24FN3O2S MolecularWeight: 413.508263

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)N(CC)C3=CC=C(C=C3)F

Isomeric SMILES

CCCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)N(CC)C3=CC=C(C=C3)F

InChI

InChI=1S/C22H24FN3O2S/c1-3-5-14-26-21(28)18-8-6-7-9-19(18)24-22(26)29-15-20(27)25(4-2)17-12-10-16(23)11-13-17/h6-13H,3-5,14-15H2,1-2H3