(3R,4S,5R)-3-(6-aminopurin-9-yl)-N-methyl-4,5-bis(oxidanyl)cyclopentene-1-carboxamide

Systemtic Name: (3R,4S,5R)-3-(6-aminopurin-9-yl)-N-methyl-4,5-bis(oxidanyl)cyclopentene-1-carboxamide Openeye Name: (3R,4S,5R)-3-(6-aminopurin-9-yl)-4,5-dihydroxy-N-methyl-cyclopentene-1-carboxamide CAS Name: (3R,4S,5R)-3-(6-aminopurin-9-yl)-4,5-dihydroxy-N-methyl-1-cyclopentenecarboxamide IUPAC Name: (3R,4S,5R)-3-(6-aminopurin-9-yl)-4,5-dihydroxy-N-methylcyclopentene-1-carboxamide Traditional Name: (3R,4S,5R)-3-adenin-9-yl-4,5-dihydroxy-N-methyl-cyclopentene-1-carboxamide Formula: C12H14N6O3 MolecularWeight: 290.27796

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=CC(C(C1O)O)N2C=NC3=C2N=CN=C3N

Isomeric SMILES

CNC(=O)C1=C[C@H]([C@@H]([C@@H]1O)O)N2C=NC3=C2N=CN=C3N

InChI

InChI=1S/C12H14N6O3/c1-14-12(21)5-2-6(9(20)8(5)19)18-4-17-7-10(13)15-3-16-11(7)18/h2-4,6,8-9,19-20H,1H3,(H,14,21)(H2,13,15,16)/t6-,8-,9+/m1/s1