2-(hydroxymethyl)-5-(6-phenylazanyl-2-propylsulfanyl-purin-9-yl)oxolane-3,4-diol

Systemtic Name: 2-(hydroxymethyl)-5-(6-phenylazanyl-2-propylsulfanyl-purin-9-yl)oxolane-3,4-diol Openeye Name: 2-(6-anilino-2-propylsulfanyl-purin-9-yl)-5-(hydroxymethyl)tetrahydrofuran-3,4-diol CAS Name: 2-[6-anilino-2-(propylthio)-9-purinyl]-5-(hydroxymethyl)oxolane-3,4-diol IUPAC Name: 2-(6-anilino-2-propylsulfanylpurin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diol Traditional Name: 2-[6-anilino-2-(propylthio)purin-9-yl]-5-methylol-tetrahydrofuran-3,4-diol Formula: C19H23N5O4S MolecularWeight: 417.48202

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=NC2=C(C(=N1)NC3=CC=CC=C3)N=CN2C4C(C(C(O4)CO)O)O

Isomeric SMILES

CCCSC1=NC2=C(C(=N1)NC3=CC=CC=C3)N=CN2C4C(C(C(O4)CO)O)O

InChI

InChI=1S/C19H23N5O4S/c1-2-8-29-19-22-16(21-11-6-4-3-5-7-11)13-17(23-19)24(10-20-13)18-15(27)14(26)12(9-25)28-18/h3-7,10,12,14-15,18,25-27H,2,8-9H2,1H3,(H,21,22,23)