N,N-dibutyl-2-(6-iodanyl-4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N,N-dibutyl-2-(6-iodanyl-4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanyl-ethanamide Openeye Name: 2-(3-allyl-6-iodo-4-oxo-quinazolin-2-yl)sulfanyl-N,N-dibutyl-acetamide CAS Name: N,N-dibutyl-2-[(6-iodo-4-oxo-3-prop-2-enyl-2-quinazolinyl)thio]acetamide IUPAC Name: N,N-dibutyl-2-(6-iodo-4-oxo-3-prop-2-enylquinazolin-2-yl)sulfanylacetamide Traditional Name: 2-[(3-allyl-6-iodo-4-keto-quinazolin-2-yl)thio]-N,N-dibutyl-acetamide Formula: C21H28IN3O2S MolecularWeight: 513.43539

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)C(=O)CSC1=NC2=C(C=C(C=C2)I)C(=O)N1CC=C

Isomeric SMILES

CCCCN(CCCC)C(=O)CSC1=NC2=C(C=C(C=C2)I)C(=O)N1CC=C

InChI

InChI=1S/C21H28IN3O2S/c1-4-7-12-24(13-8-5-2)19(26)15-28-21-23-18-10-9-16(22)14-17(18)20(27)25(21)11-6-3/h6,9-10,14H,3-5,7-8,11-13,15H2,1-2H3