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

Systemtic Name: (1R,2S,3R)-3-[(6-chloranyl-5-nitro-2-propylsulfanyl-pyrimidin-4-yl)amino]cyclopentane-1,2-diol Openeye Name: (1R,2S,3R)-3-[(6-chloro-5-nitro-2-propylsulfanyl-pyrimidin-4-yl)amino]cyclopentane-1,2-diol CAS Name: (1R,2S,3R)-3-[[6-chloro-5-nitro-2-(propylthio)-4-pyrimidinyl]amino]cyclopentane-1,2-diol IUPAC Name: (1R,2S,3R)-3-[(6-chloro-5-nitro-2-propylsulfanylpyrimidin-4-yl)amino]cyclopentane-1,2-diol Traditional Name: (1R,2S,3R)-3-[[6-chloro-5-nitro-2-(propylthio)pyrimidin-4-yl]amino]cyclopentane-1,2-diol Formula: C12H17ClN4O4S MolecularWeight: 348.80578

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=NC(=C(C(=N1)Cl)[N+](=O)[O-])NC2CCC(C2O)O

Isomeric SMILES

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

InChI

InChI=1S/C12H17ClN4O4S/c1-2-5-22-12-15-10(13)8(17(20)21)11(16-12)14-6-3-4-7(18)9(6)19/h6-7,9,18-19H,2-5H2,1H3,(H,14,15,16)/t6-,7-,9+/m1/s1