N-[5-[(5-ethyl-4-methyl-2H-1,3-thiazol-3-yl)methyl]-2-methyl-pyrimidin-4-yl]hydroxylamine diphosphate

Systemtic Name: N-[5-[(5-ethyl-4-methyl-2H-1,3-thiazol-3-yl)methyl]-2-methyl-pyrimidin-4-yl]hydroxylamine diphosphate Openeye Name: N-[5-[(5-ethyl-4-methyl-2H-thiazol-3-yl)methyl]-2-methyl-pyrimidin-4-yl]hydroxylamine diphosphate CAS Name: N-[5-[(5-ethyl-4-methyl-2H-thiazol-3-yl)methyl]-2-methyl-4-pyrimidinyl]hydroxylamine diphosphate IUPAC Name: N-[5-[(5-ethyl-4-methyl-2H-1,3-thiazol-3-yl)methyl]-2-methylpyrimidin-4-yl]hydroxylamine diphosphate Traditional Name: N-[5-[(5-ethyl-4-methyl-4-thiazolin-3-yl)methyl]-2-methyl-pyrimidin-4-yl]hydroxylamine diphosphate Formula: C12H18N4O9P2S-6 MolecularWeight: 456.305242

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N(CS1)CC2=CN=C(N=C2NO)C)C.[O-]P(=O)([O-])[O-].[O-]P(=O)([O-])[O-]

Isomeric SMILES

CCC1=C(N(CS1)CC2=CN=C(N=C2NO)C)C.[O-]P(=O)([O-])[O-].[O-]P(=O)([O-])[O-]

InChI

InChI=1S/C12H18N4OS.2H3O4P/c1-4-11-8(2)16(7-18-11)6-10-5-13-9(3)14-12(10)15-17;2*1-5(2,3)4/h5,17H,4,6-7H2,1-3H3,(H,13,14,15);2*(H3,1,2,3,4)/p-6