N-butyl-2-[3-[3-(diethylamino)propyl]-4-oxidanylidene-quinazolin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-butyl-2-[3-[3-(diethylamino)propyl]-4-oxidanylidene-quinazolin-2-yl]sulfanyl-ethanamide Openeye Name: N-butyl-2-[3-[3-(diethylamino)propyl]-4-oxo-quinazolin-2-yl]sulfanyl-acetamide CAS Name: N-butyl-2-[[3-[3-(diethylamino)propyl]-4-oxo-2-quinazolinyl]thio]acetamide IUPAC Name: N-butyl-2-[3-[3-(diethylamino)propyl]-4-oxoquinazolin-2-yl]sulfanylacetamide Traditional Name: N-butyl-2-[[3-[3-(diethylamino)propyl]-4-keto-quinazolin-2-yl]thio]acetamide Formula: C21H32N4O2S MolecularWeight: 404.56938

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)CSC1=NC2=CC=CC=C2C(=O)N1CCCN(CC)CC

Isomeric SMILES

CCCCNC(=O)CSC1=NC2=CC=CC=C2C(=O)N1CCCN(CC)CC

InChI

InChI=1S/C21H32N4O2S/c1-4-7-13-22-19(26)16-28-21-23-18-12-9-8-11-17(18)20(27)25(21)15-10-14-24(5-2)6-3/h8-9,11-12H,4-7,10,13-16H2,1-3H3,(H,22,26)