2-(3-azanyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-(2-chloranyl-4-fluoranyl-phenyl)ethanamide

Systemtic Name: 2-(3-azanyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-(2-chloranyl-4-fluoranyl-phenyl)ethanamide Openeye Name: 2-(3-amino-4-oxo-quinazolin-2-yl)sulfanyl-N-(2-chloro-4-fluoro-phenyl)acetamide CAS Name: 2-[(3-amino-4-oxo-2-quinazolinyl)thio]-N-(2-chloro-4-fluorophenyl)acetamide IUPAC Name: 2-(3-amino-4-oxoquinazolin-2-yl)sulfanyl-N-(2-chloro-4-fluorophenyl)acetamide Traditional Name: 2-[(3-amino-4-keto-quinazolin-2-yl)thio]-N-(2-chloro-4-fluoro-phenyl)acetamide Formula: C16H12ClFN4O2S MolecularWeight: 378.808483

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H12ClFN4O2S/c17-11-7-9(18)5-6-13(11)20-14(23)8-25-16-21-12-4-2-1-3-10(12)15(24)22(16)19/h1-7H,8,19H2,(H,20,23)