4-phenylpiperazine-1-carboximidamide; sulfuric acid; hydrate

Systemtic Name: 4-phenylpiperazine-1-carboximidamide; sulfuric acid; hydrate Openeye Name: 4-phenylpiperazine-1-carboxamidine; sulfuric acid; hydrate CAS Name: 4-phenyl-1-piperazinecarboximidamide; sulfuric acid; hydrate IUPAC Name: 4-phenylpiperazine-1-carboximidamide; sulfuric acid; hydrate Traditional Name: 4-phenylpiperazine-1-carboxamidine; sulfuric acid; hydrate Formula: C22H36N8O5S MolecularWeight: 524.63684

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C(=N)N.C1CN(CCN1C2=CC=CC=C2)C(=N)N.O.OS(=O)(=O)O

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C(=N)N.C1CN(CCN1C2=CC=CC=C2)C(=N)N.O.OS(=O)(=O)O

InChI

InChI=1S/2C11H16N4.H2O4S.H2O/c2*12-11(13)15-8-6-14(7-9-15)10-4-2-1-3-5-10;1-5(2,3)4;/h2*1-5H,6-9H2,(H3,12,13);(H2,1,2,3,4);1H2