3-(4-ethoxyphenyl)carbonyl-6-iodanyl-2-sulfanylidene-1H-quinazolin-4-one

Systemtic Name: 3-(4-ethoxyphenyl)carbonyl-6-iodanyl-2-sulfanylidene-1H-quinazolin-4-one Openeye Name: 3-(4-ethoxybenzoyl)-6-iodo-2-thioxo-1H-quinazolin-4-one CAS Name: 3-[(4-ethoxyphenyl)-oxomethyl]-6-iodo-2-sulfanylidene-1H-quinazolin-4-one IUPAC Name: 3-(4-ethoxybenzoyl)-6-iodo-2-sulfanylidene-1H-quinazolin-4-one Traditional Name: 3-(4-ethoxybenzoyl)-6-iodo-2-thioxo-1H-quinazolin-4-one Formula: C17H13IN2O3S MolecularWeight: 452.26619

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H13IN2O3S/c1-2-23-12-6-3-10(4-7-12)15(21)20-16(22)13-9-11(18)5-8-14(13)19-17(20)24/h3-9H,2H2,1H3,(H,19,24)