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

Systemtic Name: N-[(3-fluorophenyl)methyl]-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-[(3-fluorophenyl)methyl]-N-methyl-acetamide CAS Name: N-[(3-fluorophenyl)methyl]-N-methyl-2-[(4-oxo-3-prop-2-enyl-2-quinazolinyl)thio]acetamide IUPAC Name: N-[(3-fluorophenyl)methyl]-N-methyl-2-(4-oxo-3-prop-2-enylquinazolin-2-yl)sulfanylacetamide Traditional Name: 2-[(3-allyl-4-keto-quinazolin-2-yl)thio]-N-(3-fluorobenzyl)-N-methyl-acetamide Formula: C21H20FN3O2S MolecularWeight: 397.465803

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC(=CC=C1)F)C(=O)CSC2=NC3=CC=CC=C3C(=O)N2CC=C

Isomeric SMILES

CN(CC1=CC(=CC=C1)F)C(=O)CSC2=NC3=CC=CC=C3C(=O)N2CC=C

InChI

InChI=1S/C21H20FN3O2S/c1-3-11-25-20(27)17-9-4-5-10-18(17)23-21(25)28-14-19(26)24(2)13-15-7-6-8-16(22)12-15/h3-10,12H,1,11,13-14H2,2H3