[5-(2-azanyl-1-methyl-6-sulfanylidene-purin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methyl dihydrogen phosphate

Systemtic Name: [5-(2-azanyl-1-methyl-6-sulfanylidene-purin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methyl dihydrogen phosphate Openeye Name: [5-(2-amino-1-methyl-6-thioxo-purin-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl dihydrogen phosphate CAS Name: [5-(2-amino-1-methyl-6-sulfanylidene-9-purinyl)-3,4-dihydroxy-2-oxolanyl]methyl dihydrogen phosphate IUPAC Name: [5-(2-amino-1-methyl-6-sulfanylidenepurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl dihydrogen phosphate Traditional Name: [5-(2-amino-1-methyl-6-thioxo-purin-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl dihydrogen phosphate Formula: C11H16N5O7PS MolecularWeight: 393.312801

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=S)C2=C(N=C1N)N(C=N2)C3C(C(C(O3)COP(=O)(O)O)O)O

Isomeric SMILES

CN1C(=S)C2=C(N=C1N)N(C=N2)C3C(C(C(O3)COP(=O)(O)O)O)O

InChI

InChI=1S/C11H16N5O7PS/c1-15-10(25)5-8(14-11(15)12)16(3-13-5)9-7(18)6(17)4(23-9)2-22-24(19,20)21/h3-4,6-7,9,17-18H,2H2,1H3,(H2,12,14)(H2,19,20,21)