3-(4-fluorophenyl)-2-[(4-oxidanylidene-6-propyl-1H-pyrimidin-2-yl)sulfanylmethyl]quinazolin-4-one

Systemtic Name: 3-(4-fluorophenyl)-2-[(4-oxidanylidene-6-propyl-1H-pyrimidin-2-yl)sulfanylmethyl]quinazolin-4-one Openeye Name: 3-(4-fluorophenyl)-2-[(4-oxo-6-propyl-1H-pyrimidin-2-yl)sulfanylmethyl]quinazolin-4-one CAS Name: 3-(4-fluorophenyl)-2-[[(4-oxo-6-propyl-1H-pyrimidin-2-yl)thio]methyl]-4-quinazolinone IUPAC Name: 3-(4-fluorophenyl)-2-[(4-oxo-6-propyl-1H-pyrimidin-2-yl)sulfanylmethyl]quinazolin-4-one Traditional Name: 3-(4-fluorophenyl)-2-[[(4-keto-6-propyl-1H-pyrimidin-2-yl)thio]methyl]quinazolin-4-one Formula: C22H19FN4O2S MolecularWeight: 422.475263

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)N=C(N1)SCC2=NC3=CC=CC=C3C(=O)N2C4=CC=C(C=C4)F

Isomeric SMILES

CCCC1=CC(=O)N=C(N1)SCC2=NC3=CC=CC=C3C(=O)N2C4=CC=C(C=C4)F

InChI

InChI=1S/C22H19FN4O2S/c1-2-5-15-12-20(28)26-22(24-15)30-13-19-25-18-7-4-3-6-17(18)21(29)27(19)16-10-8-14(23)9-11-16/h3-4,6-12H,2,5,13H2,1H3,(H,24,26,28)