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

Systemtic Name: 2-[(9-methyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)methylsulfanyl]-3-propyl-quinazolin-4-one Openeye Name: 2-[(9-methyl-4-oxo-pyrido[1,2-a]pyrimidin-2-yl)methylsulfanyl]-3-propyl-quinazolin-4-one CAS Name: 2-[(9-methyl-4-oxo-2-pyrido[1,2-a]pyrimidinyl)methylthio]-3-propyl-4-quinazolinone IUPAC Name: 2-[(9-methyl-4-oxopyrido[1,2-a]pyrimidin-2-yl)methylsulfanyl]-3-propylquinazolin-4-one Traditional Name: 2-[(4-keto-9-methyl-pyrido[1,2-a]pyrimidin-2-yl)methylthio]-3-propyl-quinazolin-4-one Formula: C21H20N4O2S MolecularWeight: 392.4741

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2N=C1SCC3=CC(=O)N4C=CC=C(C4=N3)C

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2N=C1SCC3=CC(=O)N4C=CC=C(C4=N3)C

InChI

InChI=1S/C21H20N4O2S/c1-3-10-25-20(27)16-8-4-5-9-17(16)23-21(25)28-13-15-12-18(26)24-11-6-7-14(2)19(24)22-15/h4-9,11-12H,3,10,13H2,1-2H3