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

Systemtic Name: 2-[8-ethyl-2-(4-fluorophenyl)quinazolin-4-yl]sulfanyl-N-(4-methoxyphenyl)ethanamide Openeye Name: 2-[8-ethyl-2-(4-fluorophenyl)quinazolin-4-yl]sulfanyl-N-(4-methoxyphenyl)acetamide CAS Name: 2-[[8-ethyl-2-(4-fluorophenyl)-4-quinazolinyl]thio]-N-(4-methoxyphenyl)acetamide IUPAC Name: 2-[8-ethyl-2-(4-fluorophenyl)quinazolin-4-yl]sulfanyl-N-(4-methoxyphenyl)acetamide Traditional Name: 2-[[8-ethyl-2-(4-fluorophenyl)quinazolin-4-yl]thio]-N-(4-methoxyphenyl)acetamide Formula: C25H22FN3O2S MolecularWeight: 447.524483

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC2=C1N=C(N=C2SCC(=O)NC3=CC=C(C=C3)OC)C4=CC=C(C=C4)F

Isomeric SMILES

CCC1=CC=CC2=C1N=C(N=C2SCC(=O)NC3=CC=C(C=C3)OC)C4=CC=C(C=C4)F

InChI

InChI=1S/C25H22FN3O2S/c1-3-16-5-4-6-21-23(16)28-24(17-7-9-18(26)10-8-17)29-25(21)32-15-22(30)27-19-11-13-20(31-2)14-12-19/h4-14H,3,15H2,1-2H3,(H,27,30)