8-(5-diethoxyphosphorylfuran-2-yl)-2-methylsulfanyl-7H-purin-6-amine

Systemtic Name: 8-(5-diethoxyphosphorylfuran-2-yl)-2-methylsulfanyl-7H-purin-6-amine Openeye Name: 8-(5-diethoxyphosphoryl-2-furyl)-2-methylsulfanyl-7H-purin-6-amine CAS Name: 8-(5-diethoxyphosphoryl-2-furanyl)-2-(methylthio)-7H-purin-6-amine IUPAC Name: 8-(5-diethoxyphosphorylfuran-2-yl)-2-methylsulfanyl-7H-purin-6-amine Traditional Name: [8-(5-diethoxyphosphoryl-2-furyl)-2-(methylthio)-7H-purin-6-yl]amine Formula: C14H18N5O4PS MolecularWeight: 383.362581

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(C1=CC=C(O1)C2=NC3=C(N2)C(=NC(=N3)SC)N)OCC

Isomeric SMILES

CCOP(=O)(C1=CC=C(O1)C2=NC3=C(N2)C(=NC(=N3)SC)N)OCC

InChI

InChI=1S/C14H18N5O4PS/c1-4-21-24(20,22-5-2)9-7-6-8(23-9)12-16-10-11(15)17-14(25-3)19-13(10)18-12/h6-7H,4-5H2,1-3H3,(H3,15,16,17,18,19)