(1R,2R,3R,4R,5R,6S)-3-[[2,5-bis(azanyl)-6-chloranyl-pyrimidin-4-yl]amino]-6-(hydroxymethyl)bicyclo[2.2.1]heptane-2,5-diol

Systemtic Name: (1R,2R,3R,4R,5R,6S)-3-[[2,5-bis(azanyl)-6-chloranyl-pyrimidin-4-yl]amino]-6-(hydroxymethyl)bicyclo[2.2.1]heptane-2,5-diol Openeye Name: (1R,2R,3R,4R,5R,6S)-3-[(2,5-diamino-6-chloro-pyrimidin-4-yl)amino]-6-(hydroxymethyl)norbornane-2,5-diol CAS Name: (1R,2R,3R,4R,5R,6S)-3-[(2,5-diamino-6-chloro-4-pyrimidinyl)amino]-6-(hydroxymethyl)bicyclo[2.2.1]heptane-2,5-diol IUPAC Name: (1R,2R,3R,4R,5R,6S)-3-[(2,5-diamino-6-chloropyrimidin-4-yl)amino]-6-(hydroxymethyl)bicyclo[2.2.1]heptane-2,5-diol Traditional Name: (1R,2R,3R,4R,5R,6S)-3-[(2,5-diamino-6-chloro-pyrimidin-4-yl)amino]-6-methylol-norbornane-2,5-diol Formula: C12H18ClN5O3 MolecularWeight: 315.75602

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Descriptors Computed from Structure

Canonical SMILES:

C1C2C(C(C1C(C2O)NC3=C(C(=NC(=N3)N)Cl)N)O)CO

Isomeric SMILES

C1[C@@H]2[C@H]([C@@H]([C@H]1[C@H]([C@@H]2O)NC3=C(C(=NC(=N3)N)Cl)N)O)CO

InChI

InChI=1S/C12H18ClN5O3/c13-10-6(14)11(18-12(15)17-10)16-7-4-1-3(9(7)21)5(2-19)8(4)20/h3-5,7-9,19-21H,1-2,14H2,(H3,15,16,17,18)/t3-,4-,5-,7-,8-,9-/m1/s1