N-[1-(4-fluorophenyl)ethyl]-N-methyl-2-(4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[1-(4-fluorophenyl)ethyl]-N-methyl-2-(4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanyl-ethanamide Openeye Name: 2-(3-allyl-4-oxo-quinazolin-2-yl)sulfanyl-N-[1-(4-fluorophenyl)ethyl]-N-methyl-acetamide CAS Name: N-[1-(4-fluorophenyl)ethyl]-N-methyl-2-[(4-oxo-3-prop-2-enyl-2-quinazolinyl)thio]acetamide IUPAC Name: N-[1-(4-fluorophenyl)ethyl]-N-methyl-2-(4-oxo-3-prop-2-enylquinazolin-2-yl)sulfanylacetamide Traditional Name: 2-[(3-allyl-4-keto-quinazolin-2-yl)thio]-N-[1-(4-fluorophenyl)ethyl]-N-methyl-acetamide Formula: C22H22FN3O2S MolecularWeight: 411.492383

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)F)N(C)C(=O)CSC2=NC3=CC=CC=C3C(=O)N2CC=C

Isomeric SMILES

CC(C1=CC=C(C=C1)F)N(C)C(=O)CSC2=NC3=CC=CC=C3C(=O)N2CC=C

InChI

InChI=1S/C22H22FN3O2S/c1-4-13-26-21(28)18-7-5-6-8-19(18)24-22(26)29-14-20(27)25(3)15(2)16-9-11-17(23)12-10-16/h4-12,15H,1,13-14H2,2-3H3