N-[2,5-bis(fluoranyl)phenyl]-2-(6-bromanyl-3-ethyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[2,5-bis(fluoranyl)phenyl]-2-(6-bromanyl-3-ethyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-ethanamide Openeye Name: 2-(6-bromo-3-ethyl-4-oxo-quinazolin-2-yl)sulfanyl-N-(2,5-difluorophenyl)acetamide CAS Name: 2-[(6-bromo-3-ethyl-4-oxo-2-quinazolinyl)thio]-N-(2,5-difluorophenyl)acetamide IUPAC Name: 2-(6-bromo-3-ethyl-4-oxoquinazolin-2-yl)sulfanyl-N-(2,5-difluorophenyl)acetamide Traditional Name: 2-[(6-bromo-3-ethyl-4-keto-quinazolin-2-yl)thio]-N-(2,5-difluorophenyl)acetamide Formula: C18H14BrF2N3O2S MolecularWeight: 454.288466

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=C(C=CC(=C2)Br)N=C1SCC(=O)NC3=C(C=CC(=C3)F)F

Isomeric SMILES

CCN1C(=O)C2=C(C=CC(=C2)Br)N=C1SCC(=O)NC3=C(C=CC(=C3)F)F

InChI

InChI=1S/C18H14BrF2N3O2S/c1-2-24-17(26)12-7-10(19)3-6-14(12)23-18(24)27-9-16(25)22-15-8-11(20)4-5-13(15)21/h3-8H,2,9H2,1H3,(H,22,25)