2-[8-ethyl-2-(4-fluorophenyl)quinazolin-4-yl]sulfanyl-N-(3-methylbutyl)ethanamide

Systemtic Name: 2-[8-ethyl-2-(4-fluorophenyl)quinazolin-4-yl]sulfanyl-N-(3-methylbutyl)ethanamide Openeye Name: 2-[8-ethyl-2-(4-fluorophenyl)quinazolin-4-yl]sulfanyl-N-isopentyl-acetamide CAS Name: 2-[[8-ethyl-2-(4-fluorophenyl)-4-quinazolinyl]thio]-N-(3-methylbutyl)acetamide IUPAC Name: 2-[8-ethyl-2-(4-fluorophenyl)quinazolin-4-yl]sulfanyl-N-(3-methylbutyl)acetamide Traditional Name: 2-[[8-ethyl-2-(4-fluorophenyl)quinazolin-4-yl]thio]-N-isoamyl-acetamide Formula: C23H26FN3OS MolecularWeight: 411.535443

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC2=C1N=C(N=C2SCC(=O)NCCC(C)C)C3=CC=C(C=C3)F

Isomeric SMILES

CCC1=CC=CC2=C1N=C(N=C2SCC(=O)NCCC(C)C)C3=CC=C(C=C3)F

InChI

InChI=1S/C23H26FN3OS/c1-4-16-6-5-7-19-21(16)26-22(17-8-10-18(24)11-9-17)27-23(19)29-14-20(28)25-13-12-15(2)3/h5-11,15H,4,12-14H2,1-3H3,(H,25,28)