4-[bis(fluoranyl)methoxy]-N-[2-(4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanylethanoyl]benzamide

Systemtic Name: 4-[bis(fluoranyl)methoxy]-N-[2-(4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanylethanoyl]benzamide Openeye Name: N-[2-(3-allyl-4-oxo-quinazolin-2-yl)sulfanylacetyl]-4-(difluoromethoxy)benzamide CAS Name: 4-(difluoromethoxy)-N-[1-oxo-2-[(4-oxo-3-prop-2-enyl-2-quinazolinyl)thio]ethyl]benzamide IUPAC Name: 4-(difluoromethoxy)-N-[2-(4-oxo-3-prop-2-enylquinazolin-2-yl)sulfanylacetyl]benzamide Traditional Name: N-[2-[(3-allyl-4-keto-quinazolin-2-yl)thio]acetyl]-4-(difluoromethoxy)benzamide Formula: C21H17F2N3O4S MolecularWeight: 445.439186

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC(=O)C3=CC=C(C=C3)OC(F)F

Isomeric SMILES

C=CCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC(=O)C3=CC=C(C=C3)OC(F)F

InChI

InChI=1S/C21H17F2N3O4S/c1-2-11-26-19(29)15-5-3-4-6-16(15)24-21(26)31-12-17(27)25-18(28)13-7-9-14(10-8-13)30-20(22)23/h2-10,20H,1,11-12H2,(H,25,27,28)