6-bromanyl-3-[5-(3-nitrophenyl)furan-2-yl]carbonyl-2-sulfanylidene-1H-quinazolin-4-one

Systemtic Name: 6-bromanyl-3-[5-(3-nitrophenyl)furan-2-yl]carbonyl-2-sulfanylidene-1H-quinazolin-4-one Openeye Name: 6-bromo-3-[5-(3-nitrophenyl)furan-2-carbonyl]-2-thioxo-1H-quinazolin-4-one CAS Name: 6-bromo-3-[[5-(3-nitrophenyl)-2-furanyl]-oxomethyl]-2-sulfanylidene-1H-quinazolin-4-one IUPAC Name: 6-bromo-3-[5-(3-nitrophenyl)furan-2-carbonyl]-2-sulfanylidene-1H-quinazolin-4-one Traditional Name: 6-bromo-3-[5-(3-nitrophenyl)-2-furoyl]-2-thioxo-1H-quinazolin-4-one Formula: C19H10BrN3O5S MolecularWeight: 472.2688

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C2=CC=C(O2)C(=O)N3C(=O)C4=C(C=CC(=C4)Br)NC3=S

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C2=CC=C(O2)C(=O)N3C(=O)C4=C(C=CC(=C4)Br)NC3=S

InChI

InChI=1S/C19H10BrN3O5S/c20-11-4-5-14-13(9-11)17(24)22(19(29)21-14)18(25)16-7-6-15(28-16)10-2-1-3-12(8-10)23(26)27/h1-9H,(H,21,29)