2-(6-bromanyl-3-ethyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-[1-(4-fluorophenyl)ethyl]propanamide

Systemtic Name: 2-(6-bromanyl-3-ethyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-[1-(4-fluorophenyl)ethyl]propanamide Openeye Name: 2-(6-bromo-3-ethyl-4-oxo-quinazolin-2-yl)sulfanyl-N-[1-(4-fluorophenyl)ethyl]propanamide CAS Name: 2-[(6-bromo-3-ethyl-4-oxo-2-quinazolinyl)thio]-N-[1-(4-fluorophenyl)ethyl]propanamide IUPAC Name: 2-(6-bromo-3-ethyl-4-oxoquinazolin-2-yl)sulfanyl-N-[1-(4-fluorophenyl)ethyl]propanamide Traditional Name: 2-[(6-bromo-3-ethyl-4-keto-quinazolin-2-yl)thio]-N-[1-(4-fluorophenyl)ethyl]propionamide Formula: C21H21BrFN3O2S MolecularWeight: 478.377743

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=C(C=CC(=C2)Br)N=C1SC(C)C(=O)NC(C)C3=CC=C(C=C3)F

Isomeric SMILES

CCN1C(=O)C2=C(C=CC(=C2)Br)N=C1SC(C)C(=O)NC(C)C3=CC=C(C=C3)F

InChI

InChI=1S/C21H21BrFN3O2S/c1-4-26-20(28)17-11-15(22)7-10-18(17)25-21(26)29-13(3)19(27)24-12(2)14-5-8-16(23)9-6-14/h5-13H,4H2,1-3H3,(H,24,27)