N-[2,6-bis(fluoranyl)phenyl]-2-(4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanyl-propanamide

Systemtic Name: N-[2,6-bis(fluoranyl)phenyl]-2-(4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanyl-propanamide Openeye Name: 2-(3-allyl-4-oxo-quinazolin-2-yl)sulfanyl-N-(2,6-difluorophenyl)propanamide CAS Name: N-(2,6-difluorophenyl)-2-[(4-oxo-3-prop-2-enyl-2-quinazolinyl)thio]propanamide IUPAC Name: N-(2,6-difluorophenyl)-2-(4-oxo-3-prop-2-enylquinazolin-2-yl)sulfanylpropanamide Traditional Name: 2-[(3-allyl-4-keto-quinazolin-2-yl)thio]-N-(2,6-difluorophenyl)propionamide Formula: C20H17F2N3O2S MolecularWeight: 401.429686

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=CC=C1F)F)SC2=NC3=CC=CC=C3C(=O)N2CC=C

Isomeric SMILES

CC(C(=O)NC1=C(C=CC=C1F)F)SC2=NC3=CC=CC=C3C(=O)N2CC=C

InChI

InChI=1S/C20H17F2N3O2S/c1-3-11-25-19(27)13-7-4-5-10-16(13)23-20(25)28-12(2)18(26)24-17-14(21)8-6-9-15(17)22/h3-10,12H,1,11H2,2H3,(H,24,26)