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3-[4-[(9-methylpurin-6-yl)amino]cyclohexyl]oxypropane-1-sulfonic acid

3-[4-[(9-methylpurin-6-yl)amino]cyclohexyl]oxypropane-1-sulfonic acid

Systemtic Name:3-[4-[(9-methylpurin-6-yl)amino]cyclohexyl]oxypropane-1-sulfonic acid
Openeye Name:3-[4-[(9-methylpurin-6-yl)amino]cyclohexoxy]propane-1-sulfonic acid
CAS Name:3-[4-[(9-methyl-6-purinyl)amino]cyclohexyl]oxy-1-propanesulfonic acid
IUPAC Name:3-[4-[(9-methylpurin-6-yl)amino]cyclohexyl]oxypropane-1-sulfonic acid
Traditional Name:3-[4-[(9-methylpurin-6-yl)amino]cyclohexoxy]propane-1-sulfonic acid
Formula: C15H23N5O4S
MolecularWeight: 369.43922
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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC2=C1N=CN=C2NC3CCC(CC3)OCCCS(=O)(=O)O


Isomeric SMILES

CN1C=NC2=C1N=CN=C2NC3CCC(CC3)OCCCS(=O)(=O)O


InChI

InChI=1S/C15H23N5O4S/c1-20-10-18-13-14(16-9-17-15(13)20)19-11-3-5-12(6-4-11)24-7-2-8-25(21,22)23/h9-12H,2-8H2,1H3,(H,16,17,19)(H,21,22,23)


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