2-butyl-4-fluoranyl-5-(5-pentyl-1,3-dithian-2-yl)pyrimidine

Systemtic Name: 2-butyl-4-fluoranyl-5-(5-pentyl-1,3-dithian-2-yl)pyrimidine Openeye Name: 2-butyl-4-fluoro-5-(5-pentyl-1,3-dithian-2-yl)pyrimidine CAS Name: 2-butyl-4-fluoro-5-(5-pentyl-1,3-dithian-2-yl)pyrimidine IUPAC Name: 2-butyl-4-fluoro-5-(5-pentyl-1,3-dithian-2-yl)pyrimidine Traditional Name: 5-(5-amyl-1,3-dithian-2-yl)-2-butyl-4-fluoro-pyrimidine Formula: C17H27FN2S2 MolecularWeight: 342.538083

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1CSC(SC1)C2=CN=C(N=C2F)CCCC

Isomeric SMILES

CCCCCC1CSC(SC1)C2=CN=C(N=C2F)CCCC

InChI

InChI=1S/C17H27FN2S2/c1-3-5-7-8-13-11-21-17(22-12-13)14-10-19-15(9-6-4-2)20-16(14)18/h10,13,17H,3-9,11-12H2,1-2H3