3-(3-bromanyl-4-ethoxy-phenyl)carbonyl-6-iodanyl-2-sulfanylidene-1H-quinazolin-4-one

Systemtic Name: 3-(3-bromanyl-4-ethoxy-phenyl)carbonyl-6-iodanyl-2-sulfanylidene-1H-quinazolin-4-one Openeye Name: 3-(3-bromo-4-ethoxy-benzoyl)-6-iodo-2-thioxo-1H-quinazolin-4-one CAS Name: 3-[(3-bromo-4-ethoxyphenyl)-oxomethyl]-6-iodo-2-sulfanylidene-1H-quinazolin-4-one IUPAC Name: 3-(3-bromo-4-ethoxybenzoyl)-6-iodo-2-sulfanylidene-1H-quinazolin-4-one Traditional Name: 3-(3-bromo-4-ethoxy-benzoyl)-6-iodo-2-thioxo-1H-quinazolin-4-one Formula: C17H12BrIN2O3S MolecularWeight: 531.16225

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)N2C(=O)C3=C(C=CC(=C3)I)NC2=S)Br

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)N2C(=O)C3=C(C=CC(=C3)I)NC2=S)Br

InChI

InChI=1S/C17H12BrIN2O3S/c1-2-24-14-6-3-9(7-12(14)18)15(22)21-16(23)11-8-10(19)4-5-13(11)20-17(21)25/h3-8H,2H2,1H3,(H,20,25)