(2S)-N,N-diethyl-2-(6-iodanyl-4-oxidanylidene-3-phenyl-quinazolin-2-yl)sulfanyl-propanamide

Systemtic Name: (2S)-N,N-diethyl-2-(6-iodanyl-4-oxidanylidene-3-phenyl-quinazolin-2-yl)sulfanyl-propanamide Openeye Name: (2S)-N,N-diethyl-2-(6-iodo-4-oxo-3-phenyl-quinazolin-2-yl)sulfanyl-propanamide CAS Name: (2S)-N,N-diethyl-2-[(6-iodo-4-oxo-3-phenyl-2-quinazolinyl)thio]propanamide IUPAC Name: (2S)-N,N-diethyl-2-(6-iodo-4-oxo-3-phenylquinazolin-2-yl)sulfanylpropanamide Traditional Name: (2S)-N,N-diethyl-2-[(6-iodo-4-keto-3-phenyl-quinazolin-2-yl)thio]propionamide Formula: C21H22IN3O2S MolecularWeight: 507.38775

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C(C)SC1=NC2=C(C=C(C=C2)I)C(=O)N1C3=CC=CC=C3

Isomeric SMILES

CCN(CC)C(=O)[C@H](C)SC1=NC2=C(C=C(C=C2)I)C(=O)N1C3=CC=CC=C3

InChI

InChI=1S/C21H22IN3O2S/c1-4-24(5-2)19(26)14(3)28-21-23-18-12-11-15(22)13-17(18)20(27)25(21)16-9-7-6-8-10-16/h6-14H,4-5H2,1-3H3/t14-/m0/s1