(5-butyl-2-sulfanylidene-1,3-dihydroimidazol-4-yl)-(5-fluoranylpyridin-3-yl)methanone

Systemtic Name: (5-butyl-2-sulfanylidene-1,3-dihydroimidazol-4-yl)-(5-fluoranylpyridin-3-yl)methanone Openeye Name: (5-butyl-2-thioxo-1,3-dihydroimidazol-4-yl)-(5-fluoro-3-pyridyl)methanone CAS Name: (5-butyl-2-sulfanylidene-1,3-dihydroimidazol-4-yl)-(5-fluoro-3-pyridinyl)methanone IUPAC Name: (5-butyl-2-sulfanylidene-1,3-dihydroimidazol-4-yl)-(5-fluoropyridin-3-yl)methanone Traditional Name: (5-butyl-2-thioxo-4-imidazolin-4-yl)-(5-fluoro-3-pyridyl)methanone Formula: C13H14FN3OS MolecularWeight: 279.333163

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(NC(=S)N1)C(=O)C2=CC(=CN=C2)F

Isomeric SMILES

CCCCC1=C(NC(=S)N1)C(=O)C2=CC(=CN=C2)F

InChI

InChI=1S/C13H14FN3OS/c1-2-3-4-10-11(17-13(19)16-10)12(18)8-5-9(14)7-15-6-8/h5-7H,2-4H2,1H3,(H2,16,17,19)