3-[2-[di(propan-2-yl)amino]ethyl]-2-[(4-oxidanylidene-1H-quinazolin-2-yl)methylsulfanyl]quinazolin-4-one

Systemtic Name: 3-[2-[di(propan-2-yl)amino]ethyl]-2-[(4-oxidanylidene-1H-quinazolin-2-yl)methylsulfanyl]quinazolin-4-one Openeye Name: 3-[2-(diisopropylamino)ethyl]-2-[(4-oxo-1H-quinazolin-2-yl)methylsulfanyl]quinazolin-4-one CAS Name: 3-[2-[di(propan-2-yl)amino]ethyl]-2-[(4-oxo-1H-quinazolin-2-yl)methylthio]-4-quinazolinone IUPAC Name: 3-[2-[di(propan-2-yl)amino]ethyl]-2-[(4-oxo-1H-quinazolin-2-yl)methylsulfanyl]quinazolin-4-one Traditional Name: 3-[2-(diisopropylamino)ethyl]-2-[(4-keto-1H-quinazolin-2-yl)methylthio]quinazolin-4-one Formula: C25H29N5O2S MolecularWeight: 463.59506

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CCN1C(=O)C2=CC=CC=C2N=C1SCC3=NC(=O)C4=CC=CC=C4N3)C(C)C

Isomeric SMILES

CC(C)N(CCN1C(=O)C2=CC=CC=C2N=C1SCC3=NC(=O)C4=CC=CC=C4N3)C(C)C

InChI

InChI=1S/C25H29N5O2S/c1-16(2)29(17(3)4)13-14-30-24(32)19-10-6-8-12-21(19)27-25(30)33-15-22-26-20-11-7-5-9-18(20)23(31)28-22/h5-12,16-17H,13-15H2,1-4H3,(H,26,28,31)