(6-azanyl-2-azanylidene-4-piperidin-1-yl-pyrimidin-1-yl) hydrogen sulfate

Systemtic Name: (6-azanyl-2-azanylidene-4-piperidin-1-yl-pyrimidin-1-yl) hydrogen sulfate Openeye Name: [6-amino-2-imino-4-(1-piperidyl)pyrimidin-1-yl] hydrogen sulfate CAS Name: sulfuric acid [6-amino-2-imino-4-(1-piperidinyl)-1-pyrimidinyl] ester IUPAC Name: (6-amino-2-imino-4-piperidin-1-ylpyrimidin-1-yl) hydrogen sulfate Traditional Name: sulfuric acid (6-amino-2-imino-4-piperidino-pyrimidin-1-yl) ester Formula: C9H15N5O4S MolecularWeight: 289.3115

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=NC(=N)N(C(=C2)N)OS(=O)(=O)O

Isomeric SMILES

C1CCN(CC1)C2=NC(=N)N(C(=C2)N)OS(=O)(=O)O

InChI

InChI=1S/C9H15N5O4S/c10-7-6-8(13-4-2-1-3-5-13)12-9(11)14(7)18-19(15,16)17/h6,11H,1-5,10H2,(H,15,16,17)