(3aR,4S,6R,6aS)-6-[[2,5-bis(azanyl)-6-chloranyl-pyrimidin-4-yl]amino]-2,2-dimethyl-4,5,6,6a-tetrahydro-3aH-cyclopenta[d][1,3]dioxol-4-ol

Systemtic Name: (3aR,4S,6R,6aS)-6-[[2,5-bis(azanyl)-6-chloranyl-pyrimidin-4-yl]amino]-2,2-dimethyl-4,5,6,6a-tetrahydro-3aH-cyclopenta[d][1,3]dioxol-4-ol Openeye Name: (3aR,4S,6R,6aS)-6-[(2,5-diamino-6-chloro-pyrimidin-4-yl)amino]-2,2-dimethyl-4,5,6,6a-tetrahydro-3aH-cyclopenta[d][1,3]dioxol-4-ol CAS Name: (3aR,4S,6R,6aS)-6-[(2,5-diamino-6-chloro-4-pyrimidinyl)amino]-2,2-dimethyl-4,5,6,6a-tetrahydro-3aH-cyclopenta[d][1,3]dioxol-4-ol IUPAC Name: (3aR,4S,6R,6aS)-6-[(2,5-diamino-6-chloropyrimidin-4-yl)amino]-2,2-dimethyl-4,5,6,6a-tetrahydro-3aH-cyclopenta[d][1,3]dioxol-4-ol Traditional Name: (3aR,4S,6R,6aS)-6-[(2,5-diamino-6-chloro-pyrimidin-4-yl)amino]-2,2-dimethyl-4,5,6,6a-tetrahydro-3aH-cyclopenta[d][1,3]dioxol-4-ol Formula: C12H18ClN5O3 MolecularWeight: 315.75602

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OC2C(CC(C2O1)O)NC3=C(C(=NC(=N3)N)Cl)N)C

Isomeric SMILES

CC1(O[C@H]2[C@@H](C[C@@H]([C@H]2O1)O)NC3=C(C(=NC(=N3)N)Cl)N)C

InChI

InChI=1S/C12H18ClN5O3/c1-12(2)20-7-4(3-5(19)8(7)21-12)16-10-6(14)9(13)17-11(15)18-10/h4-5,7-8,19H,3,14H2,1-2H3,(H3,15,16,17,18)/t4-,5+,7+,8-/m1/s1