N-tert-butyl-2-[2-(4-fluorophenyl)-8-methyl-quinazolin-4-yl]sulfanyl-ethanamide

Systemtic Name: N-tert-butyl-2-[2-(4-fluorophenyl)-8-methyl-quinazolin-4-yl]sulfanyl-ethanamide Openeye Name: N-tert-butyl-2-[2-(4-fluorophenyl)-8-methyl-quinazolin-4-yl]sulfanyl-acetamide CAS Name: N-tert-butyl-2-[[2-(4-fluorophenyl)-8-methyl-4-quinazolinyl]thio]acetamide IUPAC Name: N-tert-butyl-2-[2-(4-fluorophenyl)-8-methylquinazolin-4-yl]sulfanylacetamide Traditional Name: N-tert-butyl-2-[[2-(4-fluorophenyl)-8-methyl-quinazolin-4-yl]thio]acetamide Formula: C21H22FN3OS MolecularWeight: 383.482283

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N=C(N=C2SCC(=O)NC(C)(C)C)C3=CC=C(C=C3)F

Isomeric SMILES

CC1=CC=CC2=C1N=C(N=C2SCC(=O)NC(C)(C)C)C3=CC=C(C=C3)F

InChI

InChI=1S/C21H22FN3OS/c1-13-6-5-7-16-18(13)23-19(14-8-10-15(22)11-9-14)24-20(16)27-12-17(26)25-21(2,3)4/h5-11H,12H2,1-4H3,(H,25,26)