N-(4-fluorophenyl)-2-[2-(4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanylethanoylamino]ethanamide

Systemtic Name: N-(4-fluorophenyl)-2-[2-(4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanylethanoylamino]ethanamide Openeye Name: 2-[[2-(3-allyl-4-oxo-quinazolin-2-yl)sulfanylacetyl]amino]-N-(4-fluorophenyl)acetamide CAS Name: N-(4-fluorophenyl)-2-[[1-oxo-2-[(4-oxo-3-prop-2-enyl-2-quinazolinyl)thio]ethyl]amino]acetamide IUPAC Name: N-(4-fluorophenyl)-2-[[2-(4-oxo-3-prop-2-enylquinazolin-2-yl)sulfanylacetyl]amino]acetamide Traditional Name: 2-[[2-[(3-allyl-4-keto-quinazolin-2-yl)thio]acetyl]amino]-N-(4-fluorophenyl)acetamide Formula: C21H19FN4O3S MolecularWeight: 426.463963

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NCC(=O)NC3=CC=C(C=C3)F

Isomeric SMILES

C=CCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NCC(=O)NC3=CC=C(C=C3)F

InChI

InChI=1S/C21H19FN4O3S/c1-2-11-26-20(29)16-5-3-4-6-17(16)25-21(26)30-13-19(28)23-12-18(27)24-15-9-7-14(22)8-10-15/h2-10H,1,11-13H2,(H,23,28)(H,24,27)