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

Systemtic Name: 5-[[5-(2-chloroethyl)-4-methyl-1,3-thiazol-3-ium-3-yl]methyl]-2-methyl-pyrimidin-4-amine Openeye Name: 5-[[5-(2-chloroethyl)-4-methyl-thiazol-3-ium-3-yl]methyl]-2-methyl-pyrimidin-4-amine CAS Name: 5-[[5-(2-chloroethyl)-4-methyl-3-thiazol-3-iumyl]methyl]-2-methyl-4-pyrimidinamine IUPAC Name: 5-[[5-(2-chloroethyl)-4-methyl-1,3-thiazol-3-ium-3-yl]methyl]-2-methylpyrimidin-4-amine Traditional Name: [5-[[5-(2-chloroethyl)-4-methyl-thiazol-3-ium-3-yl]methyl]-2-methyl-pyrimidin-4-yl]amine Formula: C12H16ClN4S+ MolecularWeight: 283.80024

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=[N+]1CC2=CN=C(N=C2N)C)CCCl

Isomeric SMILES

CC1=C(SC=[N+]1CC2=CN=C(N=C2N)C)CCCl

InChI

InChI=1S/C12H16ClN4S/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