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

Systemtic Name: 2-[(9-methyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)methylsulfanyl]-3-prop-2-enyl-quinazolin-4-one Openeye Name: 3-allyl-2-[(9-methyl-4-oxo-pyrido[1,2-a]pyrimidin-2-yl)methylsulfanyl]quinazolin-4-one CAS Name: 2-[(9-methyl-4-oxo-2-pyrido[1,2-a]pyrimidinyl)methylthio]-3-prop-2-enyl-4-quinazolinone IUPAC Name: 2-[(9-methyl-4-oxopyrido[1,2-a]pyrimidin-2-yl)methylsulfanyl]-3-prop-2-enylquinazolin-4-one Traditional Name: 3-allyl-2-[(4-keto-9-methyl-pyrido[1,2-a]pyrimidin-2-yl)methylthio]quinazolin-4-one Formula: C21H18N4O2S MolecularWeight: 390.45822

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CN2C1=NC(=CC2=O)CSC3=NC4=CC=CC=C4C(=O)N3CC=C

Isomeric SMILES

CC1=CC=CN2C1=NC(=CC2=O)CSC3=NC4=CC=CC=C4C(=O)N3CC=C

InChI

InChI=1S/C21H18N4O2S/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/h3-9,11-12H,1,10,13H2,2H3