141455
  -OEChem-05102407032D

  8  8  0     0  0  0  0  0  0999 V2000
    3.3741   -0.8586    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    3.6002    0.8586    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    4.9743   -0.1958    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000    0.1958    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    4.3656   -0.9891    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.3827   -0.7281    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.5916    0.7281    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.6088    0.9891    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
  1  5  2  0  0  0  0
  1  6  2  0  0  0  0
  2  7  2  0  0  0  0
  2  8  2  0  0  0  0
  3  5  1  0  0  0  0
  3  7  1  0  0  0  0
  4  6  1  0  0  0  0
  4  8  1  0  0  0  0
M  END
> <PUBCHEM_COMPOUND_CID>
141455

> <PUBCHEM_COMPOUND_CANONICALIZED>
1

> <PUBCHEM_CACTVS_COMPLEXITY>
106

> <PUBCHEM_CACTVS_HBOND_ACCEPTOR>
8

> <PUBCHEM_CACTVS_HBOND_DONOR>
0

> <PUBCHEM_CACTVS_ROTATABLE_BOND>
0

> <PUBCHEM_CACTVS_SUBSKEYS>
AAADcQADgABwAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAQAAAAAAAAAAAAQAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA==

> <PUBCHEM_IUPAC_OPENEYE_NAME>
1lambda4,3,5lambda4,7-tetrathia-2,4,6,8-tetrazacycloocta-1,4,5,8-tetraene

> <PUBCHEM_IUPAC_CAS_NAME>
1lambda4,3,5lambda4,7-tetrathia-2,4,6,8-tetrazacycloocta-1,4,5,8-tetraene

> <PUBCHEM_IUPAC_NAME_MARKUP>
1&lambda;<SUP>4</SUP>,3,5&lambda;<SUP>4</SUP>,7-tetrathia-2,4,6,8-tetrazacycloocta-1,4,5,8-tetraene

> <PUBCHEM_IUPAC_NAME>
1lambda4,3,5lambda4,7-tetrathia-2,4,6,8-tetrazacycloocta-1,4,5,8-tetraene

> <PUBCHEM_IUPAC_SYSTEMATIC_NAME>
1lambda4,3,5lambda4,7-tetrathia-2,4,6,8-tetrazacycloocta-1,4,5,8-tetraene

> <PUBCHEM_IUPAC_TRADITIONAL_NAME>
1lambda4,3,5lambda4,7-tetrathia-2,4,6,8-tetrazacycloocta-1,4,5,8-tetraene

> <PUBCHEM_IUPAC_INCHI>
InChI=1S/N4S4/c1-5-2-7-4-8-3-6-1

> <PUBCHEM_IUPAC_INCHIKEY>
LTPQFVPQTZSJGS-UHFFFAOYSA-N

> <PUBCHEM_XLOGP3_AA>
4.3

> <PUBCHEM_EXACT_MASS>
183.90058071

> <PUBCHEM_MOLECULAR_FORMULA>
N4S4

> <PUBCHEM_MOLECULAR_WEIGHT>
184.3

> <PUBCHEM_OPENEYE_CAN_SMILES>
N1=S=NSN=S=NS1

> <PUBCHEM_OPENEYE_ISO_SMILES>
N1=S=NSN=S=NS1

> <PUBCHEM_CACTVS_TPSA>
102

> <PUBCHEM_MONOISOTOPIC_WEIGHT>
183.90058071

> <PUBCHEM_TOTAL_CHARGE>
0

> <PUBCHEM_HEAVY_ATOM_COUNT>
8

> <PUBCHEM_ATOM_DEF_STEREO_COUNT>
0

> <PUBCHEM_ATOM_UDEF_STEREO_COUNT>
0

> <PUBCHEM_BOND_DEF_STEREO_COUNT>
0

> <PUBCHEM_BOND_UDEF_STEREO_COUNT>
0

> <PUBCHEM_ISOTOPIC_ATOM_COUNT>
0

> <PUBCHEM_COMPONENT_COUNT>
1

> <PUBCHEM_CACTVS_TAUTO_COUNT>
-1

> <PUBCHEM_COORDINATE_TYPE>
1
5
255

$$$$