(2-azanyl-6-hexyl-4-thiomorpholin-4-yl-1,2,3-triazin-1-yl) hydrogen sulfate

Systemtic Name: (2-azanyl-6-hexyl-4-thiomorpholin-4-yl-1,2,3-triazin-1-yl) hydrogen sulfate Openeye Name: (2-amino-6-hexyl-4-thiomorpholino-triazin-1-yl) hydrogen sulfate CAS Name: sulfuric acid (2-amino-6-hexyl-4-thiomorpholin-4-yl-1-triazinyl) ester IUPAC Name: (2-amino-6-hexyl-4-thiomorpholin-4-yltriazin-1-yl) hydrogen sulfate Traditional Name: sulfuric acid (2-amino-6-hexyl-4-thiomorpholino-triazin-1-yl) ester Formula: C13H25N5O4S2 MolecularWeight: 379.4987

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC(=NN(N1OS(=O)(=O)O)N)N2CCSCC2

Isomeric SMILES

CCCCCCC1=CC(=NN(N1OS(=O)(=O)O)N)N2CCSCC2

InChI

InChI=1S/C13H25N5O4S2/c1-2-3-4-5-6-12-11-13(16-7-9-23-10-8-16)15-18(14)17(12)22-24(19,20)21/h11H,2-10,14H2,1H3,(H,19,20,21)