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

Systemtic Name: 2-[8-ethyl-2-(4-fluorophenyl)quinazolin-4-yl]sulfanyl-N-propan-2-yl-ethanamide Openeye Name: 2-[8-ethyl-2-(4-fluorophenyl)quinazolin-4-yl]sulfanyl-N-isopropyl-acetamide CAS Name: 2-[[8-ethyl-2-(4-fluorophenyl)-4-quinazolinyl]thio]-N-propan-2-ylacetamide IUPAC Name: 2-[8-ethyl-2-(4-fluorophenyl)quinazolin-4-yl]sulfanyl-N-propan-2-ylacetamide Traditional Name: 2-[[8-ethyl-2-(4-fluorophenyl)quinazolin-4-yl]thio]-N-isopropyl-acetamide Formula: C21H22FN3OS MolecularWeight: 383.482283

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H22FN3OS/c1-4-14-6-5-7-17-19(14)24-20(15-8-10-16(22)11-9-15)25-21(17)27-12-18(26)23-13(2)3/h5-11,13H,4,12H2,1-3H3,(H,23,26)