2-(hydroxymethyl)-5-[6-[(Z)-3-phenylprop-2-enyl]sulfanylpurin-9-yl]oxolane-3,4-diol

Systemtic Name: 2-(hydroxymethyl)-5-[6-[(Z)-3-phenylprop-2-enyl]sulfanylpurin-9-yl]oxolane-3,4-diol Openeye Name: 2-[6-[(Z)-cinnamyl]sulfanylpurin-9-yl]-5-(hydroxymethyl)tetrahydrofuran-3,4-diol CAS Name: 2-(hydroxymethyl)-5-[6-[[(Z)-3-phenylprop-2-enyl]thio]-9-purinyl]oxolane-3,4-diol IUPAC Name: 2-(hydroxymethyl)-5-[6-[(Z)-3-phenylprop-2-enyl]sulfanylpurin-9-yl]oxolane-3,4-diol Traditional Name: 2-[6-[[(Z)-cinnamyl]thio]purin-9-yl]-5-methylol-tetrahydrofuran-3,4-diol Formula: C19H20N4O4S MolecularWeight: 400.4515

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C=CCSC2=NC=NC3=C2N=CN3C4C(C(C(O4)CO)O)O

Isomeric SMILES

C1=CC=C(C=C1)/C=C\CSC2=NC=NC3=C2N=CN3C4C(C(C(O4)CO)O)O

InChI

InChI=1S/C19H20N4O4S/c24-9-13-15(25)16(26)19(27-13)23-11-22-14-17(23)20-10-21-18(14)28-8-4-7-12-5-2-1-3-6-12/h1-7,10-11,13,15-16,19,24-26H,8-9H2/b7-4-