2-(6-ethyl-2-phenyl-quinazolin-4-yl)sulfanyl-N-[(4-fluorophenyl)methyl]ethanamide

Systemtic Name: 2-(6-ethyl-2-phenyl-quinazolin-4-yl)sulfanyl-N-[(4-fluorophenyl)methyl]ethanamide Openeye Name: 2-(6-ethyl-2-phenyl-quinazolin-4-yl)sulfanyl-N-[(4-fluorophenyl)methyl]acetamide CAS Name: 2-[(6-ethyl-2-phenyl-4-quinazolinyl)thio]-N-[(4-fluorophenyl)methyl]acetamide IUPAC Name: 2-(6-ethyl-2-phenylquinazolin-4-yl)sulfanyl-N-[(4-fluorophenyl)methyl]acetamide Traditional Name: 2-[(6-ethyl-2-phenyl-quinazolin-4-yl)thio]-N-(4-fluorobenzyl)acetamide Formula: C25H22FN3OS MolecularWeight: 431.525083

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)N=C(N=C2SCC(=O)NCC3=CC=C(C=C3)F)C4=CC=CC=C4

Isomeric SMILES

CCC1=CC2=C(C=C1)N=C(N=C2SCC(=O)NCC3=CC=C(C=C3)F)C4=CC=CC=C4

InChI

InChI=1S/C25H22FN3OS/c1-2-17-10-13-22-21(14-17)25(29-24(28-22)19-6-4-3-5-7-19)31-16-23(30)27-15-18-8-11-20(26)12-9-18/h3-14H,2,15-16H2,1H3,(H,27,30)