2-[1-(diethoxyphosphorylmethylsulfanyl)ethoxy]-7H-purin-6-amine

Systemtic Name: 2-[1-(diethoxyphosphorylmethylsulfanyl)ethoxy]-7H-purin-6-amine Openeye Name: 2-[1-(diethoxyphosphorylmethylsulfanyl)ethoxy]-7H-purin-6-amine CAS Name: 2-[1-(diethoxyphosphorylmethylthio)ethoxy]-7H-purin-6-amine IUPAC Name: 2-[1-(diethoxyphosphorylmethylsulfanyl)ethoxy]-7H-purin-6-amine Traditional Name: [2-[1-(diethoxyphosphorylmethylthio)ethoxy]-7H-purin-6-yl]amine Formula: C12H20N5O4PS MolecularWeight: 361.357061

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(CSC(C)OC1=NC2=C(C(=N1)N)NC=N2)OCC

Isomeric SMILES

CCOP(=O)(CSC(C)OC1=NC2=C(C(=N1)N)NC=N2)OCC

InChI

InChI=1S/C12H20N5O4PS/c1-4-19-22(18,20-5-2)7-23-8(3)21-12-16-10(13)9-11(17-12)15-6-14-9/h6,8H,4-5,7H2,1-3H3,(H3,13,14,15,16,17)