[5-[[5-(2-fluoranylethyl)-4-methyl-1,3-thiazol-3-ium-3-yl]methyl]-2-methyl-pyrimidin-4-yl]azanium

Systemtic Name: [5-[[5-(2-fluoranylethyl)-4-methyl-1,3-thiazol-3-ium-3-yl]methyl]-2-methyl-pyrimidin-4-yl]azanium Openeye Name: [5-[[5-(2-fluoroethyl)-4-methyl-thiazol-3-ium-3-yl]methyl]-2-methyl-pyrimidin-4-yl]ammonium CAS Name: [5-[[5-(2-fluoroethyl)-4-methyl-3-thiazol-3-iumyl]methyl]-2-methyl-4-pyrimidinyl]ammonium IUPAC Name: [5-[[5-(2-fluoroethyl)-4-methyl-1,3-thiazol-3-ium-3-yl]methyl]-2-methylpyrimidin-4-yl]azanium Traditional Name: [5-[[5-(2-fluoroethyl)-4-methyl-thiazol-3-ium-3-yl]methyl]-2-methyl-pyrimidin-4-yl]ammonium Formula: C12H17FN4S+2 MolecularWeight: 268.353583

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=[N+]1CC2=CN=C(N=C2[NH3+])C)CCF

Isomeric SMILES

CC1=C(SC=[N+]1CC2=CN=C(N=C2[NH3+])C)CCF

InChI

InChI=1S/C12H16FN4S/c1-8-11(3-4-13)18-7-17(8)6-10-5-15-9(2)16-12(10)14/h5,7H,3-4,6H2,1-2H3,(H2,14,15,16)/q+1/p+1