9-[5-[[oxidanyl(phenyl)phosphinothioyl]oxymethyl]-2,5-dihydrofuran-2-yl]purin-6-amine

Systemtic Name: 9-[5-[[oxidanyl(phenyl)phosphinothioyl]oxymethyl]-2,5-dihydrofuran-2-yl]purin-6-amine Openeye Name: 9-[5-[[hydroxy(phenyl)phosphinothioyl]oxymethyl]-2,5-dihydrofuran-2-yl]purin-6-amine CAS Name: 9-[5-[[hydroxy(phenyl)phosphinothioyl]oxymethyl]-2,5-dihydrofuran-2-yl]-6-purinamine IUPAC Name: 9-[5-[[hydroxy(phenyl)phosphinothioyl]oxymethyl]-2,5-dihydrofuran-2-yl]purin-6-amine Traditional Name: [9-[5-[[hydroxy(phenyl)thiophosphoryl]oxymethyl]-2,5-dihydrofuran-2-yl]purin-6-yl]amine Formula: C16H16N5O3PS MolecularWeight: 389.368701

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)P(=S)(O)OCC2C=CC(O2)N3C=NC4=C3N=CN=C4N

Isomeric SMILES

C1=CC=C(C=C1)P(=S)(O)OCC2C=CC(O2)N3C=NC4=C3N=CN=C4N

InChI

InChI=1S/C16H16N5O3PS/c17-15-14-16(19-9-18-15)21(10-20-14)13-7-6-11(24-13)8-23-25(22,26)12-4-2-1-3-5-12/h1-7,9-11,13H,8H2,(H,22,26)(H2,17,18,19)