2-(6-bromanyl-4-oxidanylidene-3-propyl-quinazolin-2-yl)sulfanyl-N-[(3-fluorophenyl)methyl]-N-methyl-ethanamide

Systemtic Name: 2-(6-bromanyl-4-oxidanylidene-3-propyl-quinazolin-2-yl)sulfanyl-N-[(3-fluorophenyl)methyl]-N-methyl-ethanamide Openeye Name: 2-(6-bromo-4-oxo-3-propyl-quinazolin-2-yl)sulfanyl-N-[(3-fluorophenyl)methyl]-N-methyl-acetamide CAS Name: 2-[(6-bromo-4-oxo-3-propyl-2-quinazolinyl)thio]-N-[(3-fluorophenyl)methyl]-N-methylacetamide IUPAC Name: 2-(6-bromo-4-oxo-3-propylquinazolin-2-yl)sulfanyl-N-[(3-fluorophenyl)methyl]-N-methylacetamide Traditional Name: 2-[(6-bromo-4-keto-3-propyl-quinazolin-2-yl)thio]-N-(3-fluorobenzyl)-N-methyl-acetamide Formula: C21H21BrFN3O2S MolecularWeight: 478.377743

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=C(C=CC(=C2)Br)N=C1SCC(=O)N(C)CC3=CC(=CC=C3)F

Isomeric SMILES

CCCN1C(=O)C2=C(C=CC(=C2)Br)N=C1SCC(=O)N(C)CC3=CC(=CC=C3)F

InChI

InChI=1S/C21H21BrFN3O2S/c1-3-9-26-20(28)17-11-15(22)7-8-18(17)24-21(26)29-13-19(27)25(2)12-14-5-4-6-16(23)10-14/h4-8,10-11H,3,9,12-13H2,1-2H3