7-chloranyl-3-(2-methylphenyl)-2-[(4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methylsulfanyl]quinazolin-4-one

Systemtic Name: 7-chloranyl-3-(2-methylphenyl)-2-[(4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methylsulfanyl]quinazolin-4-one Openeye Name: 7-chloro-3-(o-tolyl)-2-[(4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methylsulfanyl]quinazolin-4-one CAS Name: 7-chloro-3-(2-methylphenyl)-2-[(4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methylthio]-4-quinazolinone IUPAC Name: 7-chloro-3-(2-methylphenyl)-2-[(4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methylsulfanyl]quinazolin-4-one Traditional Name: 7-chloro-2-[(4-keto-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methylthio]-3-(o-tolyl)quinazolin-4-one Formula: C24H18ClN4O2S+ MolecularWeight: 461.94332

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=O)C3=C(C=C(C=C3)Cl)N=C2SCC4=CC(=O)[N+]5=CC=CC=C5N4

Isomeric SMILES

CC1=CC=CC=C1N2C(=O)C3=C(C=C(C=C3)Cl)N=C2SCC4=CC(=O)[N+]5=CC=CC=C5N4

InChI

InChI=1S/C24H17ClN4O2S/c1-15-6-2-3-7-20(15)29-23(31)18-10-9-16(25)12-19(18)27-24(29)32-14-17-13-22(30)28-11-5-4-8-21(28)26-17/h2-13H,14H2,1H3/p+1