dimethyl-[3-(4-oxidanylidene-2-phenacylsulfanyl-quinazolin-3-yl)propyl]azanium

Systemtic Name: dimethyl-[3-(4-oxidanylidene-2-phenacylsulfanyl-quinazolin-3-yl)propyl]azanium Openeye Name: dimethyl-[3-(4-oxo-2-phenacylsulfanyl-quinazolin-3-yl)propyl]ammonium CAS Name: dimethyl-[3-[4-oxo-2-(phenacylthio)-3-quinazolinyl]propyl]ammonium IUPAC Name: dimethyl-[3-(4-oxo-2-phenacylsulfanylquinazolin-3-yl)propyl]azanium Traditional Name: 3-[4-keto-2-(phenacylthio)quinazolin-3-yl]propyl-dimethyl-ammonium Formula: C21H24N3O2S+ MolecularWeight: 382.49916

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)C3=CC=CC=C3

Isomeric SMILES

C[NH+](C)CCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H23N3O2S/c1-23(2)13-8-14-24-20(26)17-11-6-7-12-18(17)22-21(24)27-15-19(25)16-9-4-3-5-10-16/h3-7,9-12H,8,13-15H2,1-2H3/p+1