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

Systemtic Name: N-(4-fluoranyl-2-nitro-phenyl)-2-quinazolin-4-ylsulfanyl-ethanamide Openeye Name: N-(4-fluoro-2-nitro-phenyl)-2-quinazolin-4-ylsulfanyl-acetamide CAS Name: N-(4-fluoro-2-nitrophenyl)-2-(4-quinazolinylthio)acetamide IUPAC Name: N-(4-fluoro-2-nitrophenyl)-2-quinazolin-4-ylsulfanylacetamide Traditional Name: N-(4-fluoro-2-nitro-phenyl)-2-(quinazolin-4-ylthio)acetamide Formula: C16H11FN4O3S MolecularWeight: 358.346943

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NC=N2)SCC(=O)NC3=C(C=C(C=C3)F)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=NC=N2)SCC(=O)NC3=C(C=C(C=C3)F)[N+](=O)[O-]

InChI

InChI=1S/C16H11FN4O3S/c17-10-5-6-13(14(7-10)21(23)24)20-15(22)8-25-16-11-3-1-2-4-12(11)18-9-19-16/h1-7,9H,8H2,(H,20,22)