N-(2-bromanyl-4-nitro-phenyl)-2-[2-(furan-2-yl)quinazolin-4-yl]sulfanyl-ethanamide

Systemtic Name: N-(2-bromanyl-4-nitro-phenyl)-2-[2-(furan-2-yl)quinazolin-4-yl]sulfanyl-ethanamide Openeye Name: N-(2-bromo-4-nitro-phenyl)-2-[2-(2-furyl)quinazolin-4-yl]sulfanyl-acetamide CAS Name: N-(2-bromo-4-nitrophenyl)-2-[[2-(2-furanyl)-4-quinazolinyl]thio]acetamide IUPAC Name: N-(2-bromo-4-nitrophenyl)-2-[2-(furan-2-yl)quinazolin-4-yl]sulfanylacetamide Traditional Name: N-(2-bromo-4-nitro-phenyl)-2-[[2-(2-furyl)quinazolin-4-yl]thio]acetamide Formula: C20H13BrN4O4S MolecularWeight: 485.31062

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NC(=N2)C3=CC=CO3)SCC(=O)NC4=C(C=C(C=C4)[N+](=O)[O-])Br

Isomeric SMILES

C1=CC=C2C(=C1)C(=NC(=N2)C3=CC=CO3)SCC(=O)NC4=C(C=C(C=C4)[N+](=O)[O-])Br

InChI

InChI=1S/C20H13BrN4O4S/c21-14-10-12(25(27)28)7-8-16(14)22-18(26)11-30-20-13-4-1-2-5-15(13)23-19(24-20)17-6-3-9-29-17/h1-10H,11H2,(H,22,26)