2-azanyl-5-[(tert-butylamino)methyl]-5-(hydroxymethyl)-1,3-thiazol-4-one; sulfuric acid; hydrate

Systemtic Name: 2-azanyl-5-[(tert-butylamino)methyl]-5-(hydroxymethyl)-1,3-thiazol-4-one; sulfuric acid; hydrate Openeye Name: 2-amino-5-[(tert-butylamino)methyl]-5-(hydroxymethyl)thiazol-4-one; sulfuric acid; hydrate CAS Name: 2-amino-5-[(tert-butylamino)methyl]-5-(hydroxymethyl)-4-thiazolone; sulfuric acid; hydrate IUPAC Name: 2-amino-5-[(tert-butylamino)methyl]-5-(hydroxymethyl)-1,3-thiazol-4-one; sulfuric acid; hydrate Traditional Name: 2-amino-5-[(tert-butylamino)methyl]-5-methylol-2-thiazolin-4-one; sulfuric acid; hydrate Formula: C9H21N3O7S2 MolecularWeight: 347.40894

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NCC1(C(=O)N=C(S1)N)CO.O.OS(=O)(=O)O

Isomeric SMILES

CC(C)(C)NCC1(C(=O)N=C(S1)N)CO.O.OS(=O)(=O)O

InChI

InChI=1S/C9H17N3O2S.H2O4S.H2O/c1-8(2,3)11-4-9(5-13)6(14)12-7(10)15-9;1-5(2,3)4;/h11,13H,4-5H2,1-3H3,(H2,10,12,14);(H2,1,2,3,4);1H2