6-chloranyl-9-[(2-diethoxyphosphoryl-1,3-oxathiolan-5-yl)methyl]-3,6-dihydropurin-2-amine

Systemtic Name: 6-chloranyl-9-[(2-diethoxyphosphoryl-1,3-oxathiolan-5-yl)methyl]-3,6-dihydropurin-2-amine Openeye Name: 6-chloro-9-[(2-diethoxyphosphoryl-1,3-oxathiolan-5-yl)methyl]-3,6-dihydropurin-2-amine CAS Name: 6-chloro-9-[(2-diethoxyphosphoryl-1,3-oxathiolan-5-yl)methyl]-3,6-dihydropurin-2-amine IUPAC Name: 6-chloro-9-[(2-diethoxyphosphoryl-1,3-oxathiolan-5-yl)methyl]-3,6-dihydropurin-2-amine Traditional Name: [6-chloro-9-[(2-diethoxyphosphoryl-1,3-oxathiolan-5-yl)methyl]-3,6-dihydropurin-2-yl]amine Formula: C13H21ClN5O4PS MolecularWeight: 409.828701

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(C1OC(CS1)CN2C=NC3=C2NC(=NC3Cl)N)OCC

Isomeric SMILES

CCOP(=O)(C1OC(CS1)CN2C=NC3=C2NC(=NC3Cl)N)OCC

InChI

InChI=1S/C13H21ClN5O4PS/c1-3-21-24(20,22-4-2)13-23-8(6-25-13)5-19-7-16-9-10(14)17-12(15)18-11(9)19/h7-8,10,13H,3-6H2,1-2H3,(H3,15,17,18)