2-[3-[4-[bis(fluoranyl)methoxy]phenyl]-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-tert-butyl-ethanamide

Systemtic Name: 2-[3-[4-[bis(fluoranyl)methoxy]phenyl]-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-tert-butyl-ethanamide Openeye Name: N-tert-butyl-2-[3-[4-(difluoromethoxy)phenyl]-4-oxo-quinazolin-2-yl]sulfanyl-acetamide CAS Name: N-tert-butyl-2-[[3-[4-(difluoromethoxy)phenyl]-4-oxo-2-quinazolinyl]thio]acetamide IUPAC Name: N-tert-butyl-2-[3-[4-(difluoromethoxy)phenyl]-4-oxoquinazolin-2-yl]sulfanylacetamide Traditional Name: N-tert-butyl-2-[[3-[4-(difluoromethoxy)phenyl]-4-keto-quinazolin-2-yl]thio]acetamide Formula: C21H21F2N3O3S MolecularWeight: 433.471546

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)CSC1=NC2=CC=CC=C2C(=O)N1C3=CC=C(C=C3)OC(F)F

Isomeric SMILES

CC(C)(C)NC(=O)CSC1=NC2=CC=CC=C2C(=O)N1C3=CC=C(C=C3)OC(F)F

InChI

InChI=1S/C21H21F2N3O3S/c1-21(2,3)25-17(27)12-30-20-24-16-7-5-4-6-15(16)18(28)26(20)13-8-10-14(11-9-13)29-19(22)23/h4-11,19H,12H2,1-3H3,(H,25,27)