N-[8-[2-(diethoxyphosphorylmethylsulfanyl)ethoxy]-7H-purin-2-yl]methanamide

Systemtic Name: N-[8-[2-(diethoxyphosphorylmethylsulfanyl)ethoxy]-7H-purin-2-yl]methanamide Openeye Name: N-[8-[2-(diethoxyphosphorylmethylsulfanyl)ethoxy]-7H-purin-2-yl]formamide CAS Name: N-[8-[2-(diethoxyphosphorylmethylthio)ethoxy]-7H-purin-2-yl]formamide IUPAC Name: N-[8-[2-(diethoxyphosphorylmethylsulfanyl)ethoxy]-7H-purin-2-yl]formamide Traditional Name: N-[8-[2-(diethoxyphosphorylmethylthio)ethoxy]-7H-purin-2-yl]formamide Formula: C13H20N5O5PS MolecularWeight: 389.367161

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(CSCCOC1=NC2=NC(=NC=C2N1)NC=O)OCC

Isomeric SMILES

CCOP(=O)(CSCCOC1=NC2=NC(=NC=C2N1)NC=O)OCC

InChI

InChI=1S/C13H20N5O5PS/c1-3-22-24(20,23-4-2)9-25-6-5-21-13-16-10-7-14-12(15-8-19)17-11(10)18-13/h7-8H,3-6,9H2,1-2H3,(H2,14,15,16,17,18,19)