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

Systemtic Name: 7-chloranyl-2-[(7-methyl-4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methylsulfanyl]-3-(2-methylphenyl)quinazolin-4-one Openeye Name: 7-chloro-2-[(7-methyl-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methylsulfanyl]-3-(o-tolyl)quinazolin-4-one CAS Name: 7-chloro-2-[(7-methyl-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methylthio]-3-(2-methylphenyl)-4-quinazolinone IUPAC Name: 7-chloro-2-[(7-methyl-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methylsulfanyl]-3-(2-methylphenyl)quinazolin-4-one Traditional Name: 7-chloro-2-[(4-keto-7-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methylthio]-3-(o-tolyl)quinazolin-4-one Formula: C25H20ClN4O2S+ MolecularWeight: 475.9699

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C[N+]2=C(C=C1)NC(=CC2=O)CSC3=NC4=C(C=CC(=C4)Cl)C(=O)N3C5=CC=CC=C5C

Isomeric SMILES

CC1=C[N+]2=C(C=C1)NC(=CC2=O)CSC3=NC4=C(C=CC(=C4)Cl)C(=O)N3C5=CC=CC=C5C

InChI

InChI=1S/C25H19ClN4O2S/c1-15-7-10-22-27-18(12-23(31)29(22)13-15)14-33-25-28-20-11-17(26)8-9-19(20)24(32)30(25)21-6-4-3-5-16(21)2/h3-13H,14H2,1-2H3/p+1