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

Systemtic Name: 6-iodanyl-3-(2-phenoxyethanoyl)-2-sulfanylidene-1H-quinazolin-4-one Openeye Name: 6-iodo-3-(2-phenoxyacetyl)-2-thioxo-1H-quinazolin-4-one CAS Name: 6-iodo-3-(1-oxo-2-phenoxyethyl)-2-sulfanylidene-1H-quinazolin-4-one IUPAC Name: 6-iodo-3-(2-phenoxyacetyl)-2-sulfanylidene-1H-quinazolin-4-one Traditional Name: 6-iodo-3-(2-phenoxyacetyl)-2-thioxo-1H-quinazolin-4-one Formula: C16H11IN2O3S MolecularWeight: 438.23961

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H11IN2O3S/c17-10-6-7-13-12(8-10)15(21)19(16(23)18-13)14(20)9-22-11-4-2-1-3-5-11/h1-8H,9H2,(H,18,23)