sulfuric acid; 1,3,5-trimethylpyrazol-4-amine; hydrate

Systemtic Name: sulfuric acid; 1,3,5-trimethylpyrazol-4-amine; hydrate Openeye Name: sulfuric acid; 1,3,5-trimethylpyrazol-4-amine; hydrate CAS Name: sulfuric acid; 1,3,5-trimethyl-4-pyrazolamine; hydrate IUPAC Name: sulfuric acid; 1,3,5-trimethylpyrazol-4-amine; hydrate Traditional Name: sulfuric acid; (1,3,5-trimethylpyrazol-4-yl)amine; hydrate Formula: C6H15N3O5S MolecularWeight: 241.2654

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C)N.O.OS(=O)(=O)O

Isomeric SMILES

CC1=C(C(=NN1C)C)N.O.OS(=O)(=O)O

InChI

InChI=1S/C6H11N3.H2O4S.H2O/c1-4-6(7)5(2)9(3)8-4;1-5(2,3)4;/h7H2,1-3H3;(H2,1,2,3,4);1H2