5-[[5-(2-chloroethyl)-4-methyl-1,3-thiazol-3-ium-2-yl]methyl]-2-methyl-pyrimidin-4-amine chloride

Systemtic Name: 5-[[5-(2-chloroethyl)-4-methyl-1,3-thiazol-3-ium-2-yl]methyl]-2-methyl-pyrimidin-4-amine chloride Openeye Name: 5-[[5-(2-chloroethyl)-4-methyl-thiazol-3-ium-2-yl]methyl]-2-methyl-pyrimidin-4-amine chloride CAS Name: 5-[[5-(2-chloroethyl)-4-methyl-2-thiazol-3-iumyl]methyl]-2-methyl-4-pyrimidinamine chloride IUPAC Name: 5-[[5-(2-chloroethyl)-4-methyl-1,3-thiazol-3-ium-2-yl]methyl]-2-methylpyrimidin-4-amine chloride Traditional Name: [5-[[5-(2-chloroethyl)-4-methyl-thiazol-3-ium-2-yl]methyl]-2-methyl-pyrimidin-4-yl]amine chloride Formula: C12H16Cl2N4S MolecularWeight: 319.25324

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=[NH+]1)CC2=CN=C(N=C2N)C)CCCl.[Cl-]

Isomeric SMILES

CC1=C(SC(=[NH+]1)CC2=CN=C(N=C2N)C)CCCl.[Cl-]

InChI

InChI=1S/C12H15ClN4S.ClH/c1-7-10(3-4-13)18-11(16-7)5-9-6-15-8(2)17-12(9)14;/h6H,3-5H2,1-2H3,(H2,14,15,17);1H