6,6-dimethyl-1-(4-methylsulfonylphenyl)-1,3,5-triazine-2,4-diamine chloride

Systemtic Name: 6,6-dimethyl-1-(4-methylsulfonylphenyl)-1,3,5-triazine-2,4-diamine chloride Openeye Name: 6,6-dimethyl-1-(4-methylsulfonylphenyl)-1,3,5-triazine-2,4-diamine chloride CAS Name: 6,6-dimethyl-1-(4-methylsulfonylphenyl)-1,3,5-triazine-2,4-diamine chloride IUPAC Name: 6,6-dimethyl-1-(4-methylsulfonylphenyl)-1,3,5-triazine-2,4-diamine chloride Traditional Name: [4-amino-1-(4-mesylphenyl)-6,6-dimethyl-s-triazin-2-yl]amine chloride Formula: C12H17ClN5O2S- MolecularWeight: 330.81368

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Descriptors Computed from Structure

Canonical SMILES:

CC1(N=C(N=C(N1C2=CC=C(C=C2)S(=O)(=O)C)N)N)C.[Cl-]

Isomeric SMILES

CC1(N=C(N=C(N1C2=CC=C(C=C2)S(=O)(=O)C)N)N)C.[Cl-]

InChI

InChI=1S/C12H17N5O2S.ClH/c1-12(2)16-10(13)15-11(14)17(12)8-4-6-9(7-5-8)20(3,18)19;/h4-7H,1-3H3,(H4,13,14,15,16);1H/p-1