2-[2-(4-fluorophenyl)-6-methyl-quinazolin-4-yl]sulfanyl-N-(3-methylbutyl)ethanamide

Systemtic Name: 2-[2-(4-fluorophenyl)-6-methyl-quinazolin-4-yl]sulfanyl-N-(3-methylbutyl)ethanamide Openeye Name: 2-[2-(4-fluorophenyl)-6-methyl-quinazolin-4-yl]sulfanyl-N-isopentyl-acetamide CAS Name: 2-[[2-(4-fluorophenyl)-6-methyl-4-quinazolinyl]thio]-N-(3-methylbutyl)acetamide IUPAC Name: 2-[2-(4-fluorophenyl)-6-methylquinazolin-4-yl]sulfanyl-N-(3-methylbutyl)acetamide Traditional Name: 2-[[2-(4-fluorophenyl)-6-methyl-quinazolin-4-yl]thio]-N-isoamyl-acetamide Formula: C22H24FN3OS MolecularWeight: 397.508863

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(N=C2SCC(=O)NCCC(C)C)C3=CC=C(C=C3)F

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(N=C2SCC(=O)NCCC(C)C)C3=CC=C(C=C3)F

InChI

InChI=1S/C22H24FN3OS/c1-14(2)10-11-24-20(27)13-28-22-18-12-15(3)4-9-19(18)25-21(26-22)16-5-7-17(23)8-6-16/h4-9,12,14H,10-11,13H2,1-3H3,(H,24,27)