3-(3-methoxypropyl)-2-[(9-methyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)methylsulfanyl]quinazolin-4-one

Systemtic Name: 3-(3-methoxypropyl)-2-[(9-methyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)methylsulfanyl]quinazolin-4-one Openeye Name: 3-(3-methoxypropyl)-2-[(9-methyl-4-oxo-pyrido[1,2-a]pyrimidin-2-yl)methylsulfanyl]quinazolin-4-one CAS Name: 3-(3-methoxypropyl)-2-[(9-methyl-4-oxo-2-pyrido[1,2-a]pyrimidinyl)methylthio]-4-quinazolinone IUPAC Name: 3-(3-methoxypropyl)-2-[(9-methyl-4-oxopyrido[1,2-a]pyrimidin-2-yl)methylsulfanyl]quinazolin-4-one Traditional Name: 2-[(4-keto-9-methyl-pyrido[1,2-a]pyrimidin-2-yl)methylthio]-3-(3-methoxypropyl)quinazolin-4-one Formula: C22H22N4O3S MolecularWeight: 422.50008

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CN2C1=NC(=CC2=O)CSC3=NC4=CC=CC=C4C(=O)N3CCCOC

Isomeric SMILES

CC1=CC=CN2C1=NC(=CC2=O)CSC3=NC4=CC=CC=C4C(=O)N3CCCOC

InChI

InChI=1S/C22H22N4O3S/c1-15-7-5-10-25-19(27)13-16(23-20(15)25)14-30-22-24-18-9-4-3-8-17(18)21(28)26(22)11-6-12-29-2/h3-5,7-10,13H,6,11-12,14H2,1-2H3