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

Systemtic Name: 2-(3-butyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-(2-cyanoethyl)-N-(2-fluorophenyl)ethanamide Openeye Name: 2-(3-butyl-4-oxo-quinazolin-2-yl)sulfanyl-N-(2-cyanoethyl)-N-(2-fluorophenyl)acetamide CAS Name: 2-[(3-butyl-4-oxo-2-quinazolinyl)thio]-N-(2-cyanoethyl)-N-(2-fluorophenyl)acetamide IUPAC Name: 2-(3-butyl-4-oxoquinazolin-2-yl)sulfanyl-N-(2-cyanoethyl)-N-(2-fluorophenyl)acetamide Traditional Name: 2-[(3-butyl-4-keto-quinazolin-2-yl)thio]-N-(2-cyanoethyl)-N-(2-fluorophenyl)acetamide Formula: C23H23FN4O2S MolecularWeight: 438.517723

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)N(CCC#N)C3=CC=CC=C3F

Isomeric SMILES

CCCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)N(CCC#N)C3=CC=CC=C3F

InChI

InChI=1S/C23H23FN4O2S/c1-2-3-14-28-22(30)17-9-4-6-11-19(17)26-23(28)31-16-21(29)27(15-8-13-25)20-12-7-5-10-18(20)24/h4-7,9-12H,2-3,8,14-16H2,1H3