2-[4-(ethylamino)quinazolin-2-yl]sulfanyl-N-[(3-fluorophenyl)methyl]-N-methyl-ethanamide

Systemtic Name: 2-[4-(ethylamino)quinazolin-2-yl]sulfanyl-N-[(3-fluorophenyl)methyl]-N-methyl-ethanamide Openeye Name: 2-[4-(ethylamino)quinazolin-2-yl]sulfanyl-N-[(3-fluorophenyl)methyl]-N-methyl-acetamide CAS Name: 2-[[4-(ethylamino)-2-quinazolinyl]thio]-N-[(3-fluorophenyl)methyl]-N-methylacetamide IUPAC Name: 2-[4-(ethylamino)quinazolin-2-yl]sulfanyl-N-[(3-fluorophenyl)methyl]-N-methylacetamide Traditional Name: 2-[[4-(ethylamino)quinazolin-2-yl]thio]-N-(3-fluorobenzyl)-N-methyl-acetamide Formula: C20H21FN4OS MolecularWeight: 384.470343

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=NC(=NC2=CC=CC=C21)SCC(=O)N(C)CC3=CC(=CC=C3)F

Isomeric SMILES

CCNC1=NC(=NC2=CC=CC=C21)SCC(=O)N(C)CC3=CC(=CC=C3)F

InChI

InChI=1S/C20H21FN4OS/c1-3-22-19-16-9-4-5-10-17(16)23-20(24-19)27-13-18(26)25(2)12-14-7-6-8-15(21)11-14/h4-11H,3,12-13H2,1-2H3,(H,22,23,24)