3-piperazin-1-yl-1,2-benzothiazole; sulfuric acid; hydrate

Systemtic Name: 3-piperazin-1-yl-1,2-benzothiazole; sulfuric acid; hydrate Openeye Name: 3-piperazin-1-yl-1,2-benzothiazole; sulfuric acid; hydrate CAS Name: 3-(1-piperazinyl)-1,2-benzothiazole; sulfuric acid; hydrate IUPAC Name: 3-piperazin-1-yl-1,2-benzothiazole; sulfuric acid; hydrate Traditional Name: 3-piperazino-1,2-benzothiazole; sulfuric acid; hydrate Formula: C11H17N3O5S2 MolecularWeight: 335.39978

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=NSC3=CC=CC=C32.O.OS(=O)(=O)O

Isomeric SMILES

C1CN(CCN1)C2=NSC3=CC=CC=C32.O.OS(=O)(=O)O

InChI

InChI=1S/C11H13N3S.H2O4S.H2O/c1-2-4-10-9(3-1)11(13-15-10)14-7-5-12-6-8-14;1-5(2,3)4;/h1-4,12H,5-8H2;(H2,1,2,3,4);1H2