2-(6-bromanyl-3-ethyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-cyclopropyl-2-phenyl-ethanamide

Systemtic Name: 2-(6-bromanyl-3-ethyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-cyclopropyl-2-phenyl-ethanamide Openeye Name: 2-(6-bromo-3-ethyl-4-oxo-quinazolin-2-yl)sulfanyl-N-cyclopropyl-2-phenyl-acetamide CAS Name: 2-[(6-bromo-3-ethyl-4-oxo-2-quinazolinyl)thio]-N-cyclopropyl-2-phenylacetamide IUPAC Name: 2-(6-bromo-3-ethyl-4-oxoquinazolin-2-yl)sulfanyl-N-cyclopropyl-2-phenylacetamide Traditional Name: 2-[(6-bromo-3-ethyl-4-keto-quinazolin-2-yl)thio]-N-cyclopropyl-2-phenyl-acetamide Formula: C21H20BrN3O2S MolecularWeight: 458.3714

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=C(C=CC(=C2)Br)N=C1SC(C3=CC=CC=C3)C(=O)NC4CC4

Isomeric SMILES

CCN1C(=O)C2=C(C=CC(=C2)Br)N=C1SC(C3=CC=CC=C3)C(=O)NC4CC4

InChI

InChI=1S/C21H20BrN3O2S/c1-2-25-20(27)16-12-14(22)8-11-17(16)24-21(25)28-18(13-6-4-3-5-7-13)19(26)23-15-9-10-15/h3-8,11-12,15,18H,2,9-10H2,1H3,(H,23,26)