[9-(morpholin-4-ylmethyl)purin-6-yl]sulfanylmethyl ethanoate

Systemtic Name: [9-(morpholin-4-ylmethyl)purin-6-yl]sulfanylmethyl ethanoate Openeye Name: [9-(morpholinomethyl)purin-6-yl]sulfanylmethyl acetate CAS Name: acetic acid [[9-(4-morpholinylmethyl)-6-purinyl]thio]methyl ester IUPAC Name: [9-(morpholin-4-ylmethyl)purin-6-yl]sulfanylmethyl acetate Traditional Name: acetic acid [[9-(morpholinomethyl)purin-6-yl]thio]methyl ester Formula: C13H17N5O3S MolecularWeight: 323.37078

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCSC1=NC=NC2=C1N=CN2CN3CCOCC3

Isomeric SMILES

CC(=O)OCSC1=NC=NC2=C1N=CN2CN3CCOCC3

InChI

InChI=1S/C13H17N5O3S/c1-10(19)21-9-22-13-11-12(14-6-15-13)18(7-16-11)8-17-2-4-20-5-3-17/h6-7H,2-5,8-9H2,1H3