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

Systemtic Name: 3-(6-bromanyl-4-oxidanylidene-quinazolin-3-yl)-N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]propanamide Openeye Name: 3-(6-bromo-4-oxo-quinazolin-3-yl)-N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]propanamide CAS Name: 3-(6-bromo-4-oxo-3-quinazolinyl)-N-[2-[(2-fluorophenyl)methylthio]ethyl]propanamide IUPAC Name: 3-(6-bromo-4-oxoquinazolin-3-yl)-N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]propanamide Traditional Name: 3-(6-bromo-4-keto-quinazolin-3-yl)-N-[2-[(2-fluorobenzyl)thio]ethyl]propionamide Formula: C20H19BrFN3O2S MolecularWeight: 464.351163

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CSCCNC(=O)CCN2C=NC3=C(C2=O)C=C(C=C3)Br)F

Isomeric SMILES

C1=CC=C(C(=C1)CSCCNC(=O)CCN2C=NC3=C(C2=O)C=C(C=C3)Br)F

InChI

InChI=1S/C20H19BrFN3O2S/c21-15-5-6-18-16(11-15)20(27)25(13-24-18)9-7-19(26)23-8-10-28-12-14-3-1-2-4-17(14)22/h1-6,11,13H,7-10,12H2,(H,23,26)