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

Systemtic Name: N-[(4-fluorophenyl)methyl]-2-[4-(methylamino)quinazolin-2-yl]sulfanyl-ethanamide Openeye Name: N-[(4-fluorophenyl)methyl]-2-[4-(methylamino)quinazolin-2-yl]sulfanyl-acetamide CAS Name: N-[(4-fluorophenyl)methyl]-2-[[4-(methylamino)-2-quinazolinyl]thio]acetamide IUPAC Name: N-[(4-fluorophenyl)methyl]-2-[4-(methylamino)quinazolin-2-yl]sulfanylacetamide Traditional Name: N-(4-fluorobenzyl)-2-[[4-(methylamino)quinazolin-2-yl]thio]acetamide Formula: C18H17FN4OS MolecularWeight: 356.417183

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=NC(=NC2=CC=CC=C21)SCC(=O)NCC3=CC=C(C=C3)F

Isomeric SMILES

CNC1=NC(=NC2=CC=CC=C21)SCC(=O)NCC3=CC=C(C=C3)F

InChI

InChI=1S/C18H17FN4OS/c1-20-17-14-4-2-3-5-15(14)22-18(23-17)25-11-16(24)21-10-12-6-8-13(19)9-7-12/h2-9H,10-11H2,1H3,(H,21,24)(H,20,22,23)