1-[(5-chloranyl-6-ethyl-pyrimidin-4-yl)amino]nonyl hydrogen sulfate

Systemtic Name: 1-[(5-chloranyl-6-ethyl-pyrimidin-4-yl)amino]nonyl hydrogen sulfate Openeye Name: 1-[(5-chloro-6-ethyl-pyrimidin-4-yl)amino]nonyl hydrogen sulfate CAS Name: sulfuric acid 1-[(5-chloro-6-ethyl-4-pyrimidinyl)amino]nonyl ester IUPAC Name: 1-[(5-chloro-6-ethylpyrimidin-4-yl)amino]nonyl hydrogen sulfate Traditional Name: sulfuric acid 1-[(5-chloro-6-ethyl-pyrimidin-4-yl)amino]nonyl ester Formula: C15H26ClN3O4S MolecularWeight: 379.90264

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(NC1=NC=NC(=C1Cl)CC)OS(=O)(=O)O

Isomeric SMILES

CCCCCCCCC(NC1=NC=NC(=C1Cl)CC)OS(=O)(=O)O

InChI

InChI=1S/C15H26ClN3O4S/c1-3-5-6-7-8-9-10-13(23-24(20,21)22)19-15-14(16)12(4-2)17-11-18-15/h11,13H,3-10H2,1-2H3,(H,17,18,19)(H,20,21,22)