4-(6-aminopurin-9-yl)but-2-ynyl methanesulfonate

Systemtic Name: 4-(6-aminopurin-9-yl)but-2-ynyl methanesulfonate Openeye Name: 4-(6-aminopurin-9-yl)but-2-ynyl methanesulfonate CAS Name: methanesulfonic acid 4-(6-aminopurin-9-yl)but-2-ynyl ester IUPAC Name: 4-(6-aminopurin-9-yl)but-2-ynyl methanesulfonate Traditional Name: methanesulfonic acid 4-adenin-9-ylbut-2-ynyl ester Formula: C10H11N5O3S MolecularWeight: 281.29104

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OCC#CCN1C=NC2=C1N=CN=C2N

Isomeric SMILES

CS(=O)(=O)OCC#CCN1C=NC2=C1N=CN=C2N

InChI

InChI=1S/C10H11N5O3S/c1-19(16,17)18-5-3-2-4-15-7-14-8-9(11)12-6-13-10(8)15/h6-7H,4-5H2,1H3,(H2,11,12,13)