N-butyl-2-(6-iodanyl-4-oxidanylidene-3-phenyl-quinazolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-butyl-2-(6-iodanyl-4-oxidanylidene-3-phenyl-quinazolin-2-yl)sulfanyl-ethanamide Openeye Name: N-butyl-2-(6-iodo-4-oxo-3-phenyl-quinazolin-2-yl)sulfanyl-acetamide CAS Name: N-butyl-2-[(6-iodo-4-oxo-3-phenyl-2-quinazolinyl)thio]acetamide IUPAC Name: N-butyl-2-(6-iodo-4-oxo-3-phenylquinazolin-2-yl)sulfanylacetamide Traditional Name: N-butyl-2-[(6-iodo-4-keto-3-phenyl-quinazolin-2-yl)thio]acetamide Formula: C20H20IN3O2S MolecularWeight: 493.36117

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)CSC1=NC2=C(C=C(C=C2)I)C(=O)N1C3=CC=CC=C3

Isomeric SMILES

CCCCNC(=O)CSC1=NC2=C(C=C(C=C2)I)C(=O)N1C3=CC=CC=C3

InChI

InChI=1S/C20H20IN3O2S/c1-2-3-11-22-18(25)13-27-20-23-17-10-9-14(21)12-16(17)19(26)24(20)15-7-5-4-6-8-15/h4-10,12H,2-3,11,13H2,1H3,(H,22,25)