(4R,5S,6R)-6-methyl-2-propylsulfanyl-1,4,5,6-tetrahydropyrimidine-4,5-diol

Systemtic Name: (4R,5S,6R)-6-methyl-2-propylsulfanyl-1,4,5,6-tetrahydropyrimidine-4,5-diol Openeye Name: (4R,5S,6R)-6-methyl-2-propylsulfanyl-1,4,5,6-tetrahydropyrimidine-4,5-diol CAS Name: (4R,5S,6R)-6-methyl-2-(propylthio)-1,4,5,6-tetrahydropyrimidine-4,5-diol IUPAC Name: (4R,5S,6R)-6-methyl-2-propylsulfanyl-1,4,5,6-tetrahydropyrimidine-4,5-diol Traditional Name: (4R,5S,6R)-6-methyl-2-(propylthio)-1,4,5,6-tetrahydropyrimidine-4,5-diol Formula: C8H16N2O2S MolecularWeight: 204.28984

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=NC(C(C(N1)C)O)O

Isomeric SMILES

CCCSC1=N[C@@H]([C@H]([C@H](N1)C)O)O

InChI

InChI=1S/C8H16N2O2S/c1-3-4-13-8-9-5(2)6(11)7(12)10-8/h5-7,11-12H,3-4H2,1-2H3,(H,9,10)/t5-,6+,7-/m1/s1