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

Systemtic Name: 2-[8-ethyl-2-(4-fluorophenyl)quinazolin-4-yl]sulfanyl-N-[(4-fluorophenyl)methyl]ethanamide Openeye Name: 2-[8-ethyl-2-(4-fluorophenyl)quinazolin-4-yl]sulfanyl-N-[(4-fluorophenyl)methyl]acetamide CAS Name: 2-[[8-ethyl-2-(4-fluorophenyl)-4-quinazolinyl]thio]-N-[(4-fluorophenyl)methyl]acetamide IUPAC Name: 2-[8-ethyl-2-(4-fluorophenyl)quinazolin-4-yl]sulfanyl-N-[(4-fluorophenyl)methyl]acetamide Traditional Name: 2-[[8-ethyl-2-(4-fluorophenyl)quinazolin-4-yl]thio]-N-(4-fluorobenzyl)acetamide Formula: C25H21F2N3OS MolecularWeight: 449.515546

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC2=C1N=C(N=C2SCC(=O)NCC3=CC=C(C=C3)F)C4=CC=C(C=C4)F

Isomeric SMILES

CCC1=CC=CC2=C1N=C(N=C2SCC(=O)NCC3=CC=C(C=C3)F)C4=CC=C(C=C4)F

InChI

InChI=1S/C25H21F2N3OS/c1-2-17-4-3-5-21-23(17)29-24(18-8-12-20(27)13-9-18)30-25(21)32-15-22(31)28-14-16-6-10-19(26)11-7-16/h3-13H,2,14-15H2,1H3,(H,28,31)