2-[(3-fluorophenyl)methylsulfanyl]-7-morpholin-4-ylcarbonyl-3-prop-2-enyl-quinazolin-4-one

Systemtic Name: 2-[(3-fluorophenyl)methylsulfanyl]-7-morpholin-4-ylcarbonyl-3-prop-2-enyl-quinazolin-4-one Openeye Name: 3-allyl-2-[(3-fluorophenyl)methylsulfanyl]-7-(morpholine-4-carbonyl)quinazolin-4-one CAS Name: 2-[(3-fluorophenyl)methylthio]-7-[4-morpholinyl(oxo)methyl]-3-prop-2-enyl-4-quinazolinone IUPAC Name: 2-[(3-fluorophenyl)methylsulfanyl]-7-(morpholine-4-carbonyl)-3-prop-2-enylquinazolin-4-one Traditional Name: 3-allyl-2-[(3-fluorobenzyl)thio]-7-(morpholine-4-carbonyl)quinazolin-4-one Formula: C23H22FN3O3S MolecularWeight: 439.502483

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H22FN3O3S/c1-2-8-27-22(29)19-7-6-17(21(28)26-9-11-30-12-10-26)14-20(19)25-23(27)31-15-16-4-3-5-18(24)13-16/h2-7,13-14H,1,8-12,15H2