2-(7H-purin-6-ylsulfanyl)ethyl 2-methylprop-2-enoate

Systemtic Name: 2-(7H-purin-6-ylsulfanyl)ethyl 2-methylprop-2-enoate Openeye Name: 2-(7H-purin-6-ylsulfanyl)ethyl 2-methylprop-2-enoate CAS Name: 2-methyl-2-propenoic acid 2-(7H-purin-6-ylthio)ethyl ester IUPAC Name: 2-(7H-purin-6-ylsulfanyl)ethyl 2-methylprop-2-enoate Traditional Name: 2-methylacrylic acid 2-(7H-purin-6-ylthio)ethyl ester Formula: C11H12N4O2S MolecularWeight: 264.30358

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)C(=O)OCCSC1=NC=NC2=C1NC=N2

Isomeric SMILES

CC(=C)C(=O)OCCSC1=NC=NC2=C1NC=N2

InChI

InChI=1S/C11H12N4O2S/c1-7(2)11(16)17-3-4-18-10-8-9(13-5-12-8)14-6-15-10/h5-6H,1,3-4H2,2H3,(H,12,13,14,15)