2-(2-azanyl-4-oxidanylidene-1,7-dihydropyrrolo[2,3-d]pyrimidin-6-yl)ethyl methanesulfonate

Systemtic Name: 2-(2-azanyl-4-oxidanylidene-1,7-dihydropyrrolo[2,3-d]pyrimidin-6-yl)ethyl methanesulfonate Openeye Name: 2-(2-amino-4-oxo-1,7-dihydropyrrolo[2,3-d]pyrimidin-6-yl)ethyl methanesulfonate CAS Name: methanesulfonic acid 2-(2-amino-4-oxo-1,7-dihydropyrrolo[2,3-d]pyrimidin-6-yl)ethyl ester IUPAC Name: 2-(2-amino-4-oxo-1,7-dihydropyrrolo[2,3-d]pyrimidin-6-yl)ethyl methanesulfonate Traditional Name: methanesulfonic acid 2-(2-amino-4-keto-1,7-dihydropyrrolo[2,3-d]pyrimidin-6-yl)ethyl ester Formula: C9H12N4O4S MolecularWeight: 272.28098

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OCCC1=CC2=C(N1)NC(=NC2=O)N

Isomeric SMILES

CS(=O)(=O)OCCC1=CC2=C(N1)NC(=NC2=O)N

InChI

InChI=1S/C9H12N4O4S/c1-18(15,16)17-3-2-5-4-6-7(11-5)12-9(10)13-8(6)14/h4H,2-3H2,1H3,(H4,10,11,12,13,14)