3-[2-[2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethylsulfanyl]-4-oxidanylidene-quinazolin-3-yl]propyl-dimethyl-azanium

Systemtic Name: 3-[2-[2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethylsulfanyl]-4-oxidanylidene-quinazolin-3-yl]propyl-dimethyl-azanium Openeye Name: 3-[2-[2-(1,3-dioxoisoindolin-2-yl)ethylsulfanyl]-4-oxo-quinazolin-3-yl]propyl-dimethyl-ammonium CAS Name: 3-[2-[2-(1,3-dioxo-2-isoindolyl)ethylthio]-4-oxo-3-quinazolinyl]propyl-dimethylammonium IUPAC Name: 3-[2-[2-(1,3-dioxoisoindol-2-yl)ethylsulfanyl]-4-oxoquinazolin-3-yl]propyl-dimethylazanium Traditional Name: 3-[4-keto-2-(2-phthalimidoethylthio)quinazolin-3-yl]propyl-dimethyl-ammonium Formula: C23H25N4O3S+ MolecularWeight: 437.5346

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCN1C(=O)C2=CC=CC=C2N=C1SCCN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

C[NH+](C)CCCN1C(=O)C2=CC=CC=C2N=C1SCCN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C23H24N4O3S/c1-25(2)12-7-13-27-22(30)18-10-5-6-11-19(18)24-23(27)31-15-14-26-20(28)16-8-3-4-9-17(16)21(26)29/h3-6,8-11H,7,12-15H2,1-2H3/p+1