N-(4-bromanyl-2-fluoranyl-phenyl)-2-quinazolin-4-ylsulfanyl-ethanamide

Systemtic Name: N-(4-bromanyl-2-fluoranyl-phenyl)-2-quinazolin-4-ylsulfanyl-ethanamide Openeye Name: N-(4-bromo-2-fluoro-phenyl)-2-quinazolin-4-ylsulfanyl-acetamide CAS Name: N-(4-bromo-2-fluorophenyl)-2-(4-quinazolinylthio)acetamide IUPAC Name: N-(4-bromo-2-fluorophenyl)-2-quinazolin-4-ylsulfanylacetamide Traditional Name: N-(4-bromo-2-fluoro-phenyl)-2-(quinazolin-4-ylthio)acetamide Formula: C16H11BrFN3OS MolecularWeight: 392.245443

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NC=N2)SCC(=O)NC3=C(C=C(C=C3)Br)F

Isomeric SMILES

C1=CC=C2C(=C1)C(=NC=N2)SCC(=O)NC3=C(C=C(C=C3)Br)F

InChI

InChI=1S/C16H11BrFN3OS/c17-10-5-6-14(12(18)7-10)21-15(22)8-23-16-11-3-1-2-4-13(11)19-9-20-16/h1-7,9H,8H2,(H,21,22)