3-[3-(diethylamino)propyl]-2-[(4-oxidanylidene-1H-quinazolin-2-yl)methylsulfanyl]quinazolin-4-one

Systemtic Name: 3-[3-(diethylamino)propyl]-2-[(4-oxidanylidene-1H-quinazolin-2-yl)methylsulfanyl]quinazolin-4-one Openeye Name: 3-[3-(diethylamino)propyl]-2-[(4-oxo-1H-quinazolin-2-yl)methylsulfanyl]quinazolin-4-one CAS Name: 3-[3-(diethylamino)propyl]-2-[(4-oxo-1H-quinazolin-2-yl)methylthio]-4-quinazolinone IUPAC Name: 3-[3-(diethylamino)propyl]-2-[(4-oxo-1H-quinazolin-2-yl)methylsulfanyl]quinazolin-4-one Traditional Name: 3-[3-(diethylamino)propyl]-2-[(4-keto-1H-quinazolin-2-yl)methylthio]quinazolin-4-one Formula: C24H27N5O2S MolecularWeight: 449.56848

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCCN1C(=O)C2=CC=CC=C2N=C1SCC3=NC(=O)C4=CC=CC=C4N3

Isomeric SMILES

CCN(CC)CCCN1C(=O)C2=CC=CC=C2N=C1SCC3=NC(=O)C4=CC=CC=C4N3

InChI

InChI=1S/C24H27N5O2S/c1-3-28(4-2)14-9-15-29-23(31)18-11-6-8-13-20(18)26-24(29)32-16-21-25-19-12-7-5-10-17(19)22(30)27-21/h5-8,10-13H,3-4,9,14-16H2,1-2H3,(H,25,27,30)