2-(6-bromanyl-4-oxidanylidene-3-propyl-quinazolin-2-yl)sulfanyl-N-(2-methyl-6-nitro-phenyl)ethanamide

Systemtic Name: 2-(6-bromanyl-4-oxidanylidene-3-propyl-quinazolin-2-yl)sulfanyl-N-(2-methyl-6-nitro-phenyl)ethanamide Openeye Name: 2-(6-bromo-4-oxo-3-propyl-quinazolin-2-yl)sulfanyl-N-(2-methyl-6-nitro-phenyl)acetamide CAS Name: 2-[(6-bromo-4-oxo-3-propyl-2-quinazolinyl)thio]-N-(2-methyl-6-nitrophenyl)acetamide IUPAC Name: 2-(6-bromo-4-oxo-3-propylquinazolin-2-yl)sulfanyl-N-(2-methyl-6-nitrophenyl)acetamide Traditional Name: 2-[(6-bromo-4-keto-3-propyl-quinazolin-2-yl)thio]-N-(2-methyl-6-nitro-phenyl)acetamide Formula: C20H19BrN4O4S MolecularWeight: 491.35826

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=C(C=CC(=C2)Br)N=C1SCC(=O)NC3=C(C=CC=C3[N+](=O)[O-])C

Isomeric SMILES

CCCN1C(=O)C2=C(C=CC(=C2)Br)N=C1SCC(=O)NC3=C(C=CC=C3[N+](=O)[O-])C

InChI

InChI=1S/C20H19BrN4O4S/c1-3-9-24-19(27)14-10-13(21)7-8-15(14)22-20(24)30-11-17(26)23-18-12(2)5-4-6-16(18)25(28)29/h4-8,10H,3,9,11H2,1-2H3,(H,23,26)