2-[(6-iodanyl-4-oxidanylidene-1H-quinazolin-2-yl)sulfanyl]-N-phenethyl-ethanamide

Systemtic Name: 2-[(6-iodanyl-4-oxidanylidene-1H-quinazolin-2-yl)sulfanyl]-N-phenethyl-ethanamide Openeye Name: 2-[(6-iodo-4-oxo-1H-quinazolin-2-yl)sulfanyl]-N-phenethyl-acetamide CAS Name: 2-[(6-iodo-4-oxo-1H-quinazolin-2-yl)thio]-N-phenethylacetamide IUPAC Name: 2-[(6-iodo-4-oxo-1H-quinazolin-2-yl)sulfanyl]-N-phenethylacetamide Traditional Name: 2-[(6-iodo-4-keto-1H-quinazolin-2-yl)thio]-N-phenethyl-acetamide Formula: C18H16IN3O2S MolecularWeight: 465.30801

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC(=O)CSC2=NC(=O)C3=C(N2)C=CC(=C3)I

Isomeric SMILES

C1=CC=C(C=C1)CCNC(=O)CSC2=NC(=O)C3=C(N2)C=CC(=C3)I

InChI

InChI=1S/C18H16IN3O2S/c19-13-6-7-15-14(10-13)17(24)22-18(21-15)25-11-16(23)20-9-8-12-4-2-1-3-5-12/h1-7,10H,8-9,11H2,(H,20,23)(H,21,22,24)