N-(6-fluoranyl-1,3-benzothiazol-2-yl)-2-(4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(6-fluoranyl-1,3-benzothiazol-2-yl)-2-(4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanyl-ethanamide Openeye Name: 2-(3-allyl-4-oxo-quinazolin-2-yl)sulfanyl-N-(6-fluoro-1,3-benzothiazol-2-yl)acetamide CAS Name: N-(6-fluoro-1,3-benzothiazol-2-yl)-2-[(4-oxo-3-prop-2-enyl-2-quinazolinyl)thio]acetamide IUPAC Name: N-(6-fluoro-1,3-benzothiazol-2-yl)-2-(4-oxo-3-prop-2-enylquinazolin-2-yl)sulfanylacetamide Traditional Name: 2-[(3-allyl-4-keto-quinazolin-2-yl)thio]-N-(6-fluoro-1,3-benzothiazol-2-yl)acetamide Formula: C20H15FN4O2S2 MolecularWeight: 426.487103

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC3=NC4=C(S3)C=C(C=C4)F

Isomeric SMILES

C=CCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC3=NC4=C(S3)C=C(C=C4)F

InChI

InChI=1S/C20H15FN4O2S2/c1-2-9-25-18(27)13-5-3-4-6-14(13)23-20(25)28-11-17(26)24-19-22-15-8-7-12(21)10-16(15)29-19/h2-8,10H,1,9,11H2,(H,22,24,26)