N-(3-chloranyl-4-fluoranyl-phenyl)-2-quinazolin-4-ylsulfanyl-ethanamide

Systemtic Name: N-(3-chloranyl-4-fluoranyl-phenyl)-2-quinazolin-4-ylsulfanyl-ethanamide Openeye Name: N-(3-chloro-4-fluoro-phenyl)-2-quinazolin-4-ylsulfanyl-acetamide CAS Name: N-(3-chloro-4-fluorophenyl)-2-(4-quinazolinylthio)acetamide IUPAC Name: N-(3-chloro-4-fluorophenyl)-2-quinazolin-4-ylsulfanylacetamide Traditional Name: N-(3-chloro-4-fluoro-phenyl)-2-(quinazolin-4-ylthio)acetamide Formula: C16H11ClFN3OS MolecularWeight: 347.794443

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H11ClFN3OS/c17-12-7-10(5-6-13(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)