2-(2-cyclohexylethyl)-8-(diethoxyphosphorylmethylsulfanyl)-7H-purin-6-amine

Systemtic Name: 2-(2-cyclohexylethyl)-8-(diethoxyphosphorylmethylsulfanyl)-7H-purin-6-amine Openeye Name: 2-(2-cyclohexylethyl)-8-(diethoxyphosphorylmethylsulfanyl)-7H-purin-6-amine CAS Name: 2-(2-cyclohexylethyl)-8-(diethoxyphosphorylmethylthio)-7H-purin-6-amine IUPAC Name: 2-(2-cyclohexylethyl)-8-(diethoxyphosphorylmethylsulfanyl)-7H-purin-6-amine Traditional Name: [2-(2-cyclohexylethyl)-8-(diethoxyphosphorylmethylthio)-7H-purin-6-yl]amine Formula: C18H30N5O3PS MolecularWeight: 427.501261

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(CSC1=NC2=C(N1)C(=NC(=N2)CCC3CCCCC3)N)OCC

Isomeric SMILES

CCOP(=O)(CSC1=NC2=C(N1)C(=NC(=N2)CCC3CCCCC3)N)OCC

InChI

InChI=1S/C18H30N5O3PS/c1-3-25-27(24,26-4-2)12-28-18-22-15-16(19)20-14(21-17(15)23-18)11-10-13-8-6-5-7-9-13/h13H,3-12H2,1-2H3,(H3,19,20,21,22,23)