N-[3,4-bis(fluoranyl)phenyl]-2-quinazolin-4-ylsulfanyl-ethanamide

Systemtic Name: N-[3,4-bis(fluoranyl)phenyl]-2-quinazolin-4-ylsulfanyl-ethanamide Openeye Name: N-(3,4-difluorophenyl)-2-quinazolin-4-ylsulfanyl-acetamide CAS Name: N-(3,4-difluorophenyl)-2-(4-quinazolinylthio)acetamide IUPAC Name: N-(3,4-difluorophenyl)-2-quinazolin-4-ylsulfanylacetamide Traditional Name: N-(3,4-difluorophenyl)-2-(quinazolin-4-ylthio)acetamide Formula: C16H11F2N3OS MolecularWeight: 331.339846

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H11F2N3OS/c17-12-6-5-10(7-13(12)18)21-15(22)8-23-16-11-3-1-2-4-14(11)19-9-20-16/h1-7,9H,8H2,(H,21,22)