(1R,2S,3R)-3-[(5-azanyl-6-chloranyl-2-propylsulfanyl-pyrimidin-4-yl)amino]cyclopentane-1,2-diol

Systemtic Name: (1R,2S,3R)-3-[(5-azanyl-6-chloranyl-2-propylsulfanyl-pyrimidin-4-yl)amino]cyclopentane-1,2-diol Openeye Name: (1R,2S,3R)-3-[(5-amino-6-chloro-2-propylsulfanyl-pyrimidin-4-yl)amino]cyclopentane-1,2-diol CAS Name: (1R,2S,3R)-3-[[5-amino-6-chloro-2-(propylthio)-4-pyrimidinyl]amino]cyclopentane-1,2-diol IUPAC Name: (1R,2S,3R)-3-[(5-amino-6-chloro-2-propylsulfanylpyrimidin-4-yl)amino]cyclopentane-1,2-diol Traditional Name: (1R,2S,3R)-3-[[5-amino-6-chloro-2-(propylthio)pyrimidin-4-yl]amino]cyclopentane-1,2-diol Formula: C12H19ClN4O2S MolecularWeight: 318.82286

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=NC(=C(C(=N1)Cl)N)NC2CCC(C2O)O

Isomeric SMILES

CCCSC1=NC(=C(C(=N1)Cl)N)N[C@@H]2CC[C@H]([C@H]2O)O

InChI

InChI=1S/C12H19ClN4O2S/c1-2-5-20-12-16-10(13)8(14)11(17-12)15-6-3-4-7(18)9(6)19/h6-7,9,18-19H,2-5,14H2,1H3,(H,15,16,17)/t6-,7-,9+/m1/s1