2-[[2,5-bis(fluoranyl)phenyl]methylsulfanyl]-7-morpholin-4-ylcarbonyl-3-prop-2-enyl-quinazolin-4-one

Systemtic Name: 2-[[2,5-bis(fluoranyl)phenyl]methylsulfanyl]-7-morpholin-4-ylcarbonyl-3-prop-2-enyl-quinazolin-4-one Openeye Name: 3-allyl-2-[(2,5-difluorophenyl)methylsulfanyl]-7-(morpholine-4-carbonyl)quinazolin-4-one CAS Name: 2-[(2,5-difluorophenyl)methylthio]-7-[4-morpholinyl(oxo)methyl]-3-prop-2-enyl-4-quinazolinone IUPAC Name: 2-[(2,5-difluorophenyl)methylsulfanyl]-7-(morpholine-4-carbonyl)-3-prop-2-enylquinazolin-4-one Traditional Name: 3-allyl-2-[(2,5-difluorobenzyl)thio]-7-(morpholine-4-carbonyl)quinazolin-4-one Formula: C23H21F2N3O3S MolecularWeight: 457.492946

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=O)C2=C(C=C(C=C2)C(=O)N3CCOCC3)N=C1SCC4=C(C=CC(=C4)F)F

Isomeric SMILES

C=CCN1C(=O)C2=C(C=C(C=C2)C(=O)N3CCOCC3)N=C1SCC4=C(C=CC(=C4)F)F

InChI

InChI=1S/C23H21F2N3O3S/c1-2-7-28-22(30)18-5-3-15(21(29)27-8-10-31-11-9-27)13-20(18)26-23(28)32-14-16-12-17(24)4-6-19(16)25/h2-6,12-13H,1,7-11,14H2