1-(2-chlorophenyl)sulfonyl-2-(4,6-dimethylpyrimidin-2-yl)-1-methyl-guanidine; sulfuric acid

Systemtic Name: 1-(2-chlorophenyl)sulfonyl-2-(4,6-dimethylpyrimidin-2-yl)-1-methyl-guanidine; sulfuric acid Openeye Name: 1-(2-chlorophenyl)sulfonyl-2-(4,6-dimethylpyrimidin-2-yl)-1-methyl-guanidine; sulfuric acid CAS Name: 1-(2-chlorophenyl)sulfonyl-2-(4,6-dimethyl-2-pyrimidinyl)-1-methylguanidine; sulfuric acid IUPAC Name: 1-(2-chlorophenyl)sulfonyl-2-(4,6-dimethylpyrimidin-2-yl)-1-methylguanidine; sulfuric acid Traditional Name: 1-(2-chlorophenyl)sulfonyl-2-(4,6-dimethylpyrimidin-2-yl)-1-methyl-guanidine; sulfuric acid Formula: C14H20ClN5O10S3 MolecularWeight: 549.9841

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)N=C(N)N(C)S(=O)(=O)C2=CC=CC=C2Cl)C.OS(=O)(=O)O.OS(=O)(=O)O

Isomeric SMILES

CC1=CC(=NC(=N1)/N=C(/N)\N(C)S(=O)(=O)C2=CC=CC=C2Cl)C.OS(=O)(=O)O.OS(=O)(=O)O

InChI

InChI=1S/C14H16ClN5O2S.2H2O4S/c1-9-8-10(2)18-14(17-9)19-13(16)20(3)23(21,22)12-7-5-4-6-11(12)15;2*1-5(2,3)4/h4-8H,1-3H3,(H2,16,17,18,19);2*(H2,1,2,3,4)