1-butyl-8-fluoranyl-2-methyl-6-nitro-quinazoline-4-thione

Systemtic Name: 1-butyl-8-fluoranyl-2-methyl-6-nitro-quinazoline-4-thione Openeye Name: 1-butyl-8-fluoro-2-methyl-6-nitro-quinazoline-4-thione CAS Name: 1-butyl-8-fluoro-2-methyl-6-nitro-4-quinazolinethione IUPAC Name: 1-butyl-8-fluoro-2-methyl-6-nitroquinazoline-4-thione Traditional Name: 1-butyl-8-fluoro-2-methyl-6-nitro-quinazoline-4-thione Formula: C13H14FN3O2S MolecularWeight: 295.332563

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=NC(=S)C2=CC(=CC(=C21)F)[N+](=O)[O-])C

Isomeric SMILES

CCCCN1C(=NC(=S)C2=CC(=CC(=C21)F)[N+](=O)[O-])C

InChI

InChI=1S/C13H14FN3O2S/c1-3-4-5-16-8(2)15-13(20)10-6-9(17(18)19)7-11(14)12(10)16/h6-7H,3-5H2,1-2H3