219234
  -OEChem-05042400292D

 23 23  0     0  0  0  0  0  0999 V2000
    2.4030    0.4400    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    3.4030    0.4400    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0
    3.4030    1.4400    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.4030    0.4400    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.5369    1.9400    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.9030    1.3060    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.4030   -0.5600    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5369   -1.0600    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2690   -1.0600    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5369   -2.0600    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2690   -2.0600    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4030   -2.5600    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000   -0.7500    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8059   -0.7500    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9399    1.7500    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7130   -0.0969    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000   -2.3700    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8059   -2.3700    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4030   -3.1800    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5369    2.5600    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000    1.6300    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.5230    1.3060    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5930    1.8430    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  2  4  1  0  0  0  0
  2  7  1  0  0  0  0
  3  5  1  0  0  0  0
  3 15  1  0  0  0  0
  4  6  1  0  0  0  0
  4 16  1  0  0  0  0
  5 20  1  0  0  0  0
  5 21  1  0  0  0  0
  6 22  1  0  0  0  0
  6 23  1  0  0  0  0
  7  8  2  0  0  0  0
  7  9  1  0  0  0  0
  8 10  1  0  0  0  0
  8 13  1  0  0  0  0
  9 11  2  0  0  0  0
  9 14  1  0  0  0  0
 10 12  2  0  0  0  0
 10 17  1  0  0  0  0
 11 12  1  0  0  0  0
 11 18  1  0  0  0  0
 12 19  1  0  0  0  0
M  END
> <PUBCHEM_COMPOUND_CID>
219234

> <PUBCHEM_COMPOUND_CANONICALIZED>
1

> <PUBCHEM_CACTVS_COMPLEXITY>
172

> <PUBCHEM_CACTVS_HBOND_ACCEPTOR>
5

> <PUBCHEM_CACTVS_HBOND_DONOR>
4

> <PUBCHEM_CACTVS_ROTATABLE_BOND>
3

> <PUBCHEM_CACTVS_SUBSKEYS>
AAADccBjgAJAAAAAAAAAAAAAAAAAAAAAAAAwAAAAAAAAAAABAAAAGAgYgAAACACAEAAwAIACAACAACBCAAACAAAgAAIIiAAAAIgIICKAERCAIAAggAAIiAcAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA==

> <PUBCHEM_IUPAC_OPENEYE_NAME>
[hydrazino(phenyl)phosphinothioyl]hydrazine

> <PUBCHEM_IUPAC_CAS_NAME>
[hydrazinyl(phenyl)phosphinothioyl]hydrazine

> <PUBCHEM_IUPAC_NAME_MARKUP>
[hydrazinyl(phenyl)phosphinothioyl]hydrazine

> <PUBCHEM_IUPAC_NAME>
[hydrazinyl(phenyl)phosphinothioyl]hydrazine

> <PUBCHEM_IUPAC_SYSTEMATIC_NAME>
[diazanyl(phenyl)phosphinothioyl]diazane

> <PUBCHEM_IUPAC_TRADITIONAL_NAME>
[hydrazino(phenyl)thiophosphoryl]hydrazine

> <PUBCHEM_IUPAC_INCHI>
InChI=1S/C6H11N4PS/c7-9-11(12,10-8)6-4-2-1-3-5-6/h1-5H,7-8H2,(H2,9,10,12)

> <PUBCHEM_IUPAC_INCHIKEY>
HDCICIWMRHHDMV-UHFFFAOYSA-N

> <PUBCHEM_XLOGP3_AA>
0.7

> <PUBCHEM_EXACT_MASS>
202.04420454

> <PUBCHEM_MOLECULAR_FORMULA>
C6H11N4PS

> <PUBCHEM_MOLECULAR_WEIGHT>
202.22

> <PUBCHEM_OPENEYE_CAN_SMILES>
C1=CC=C(C=C1)P(=S)(NN)NN

> <PUBCHEM_OPENEYE_ISO_SMILES>
C1=CC=C(C=C1)P(=S)(NN)NN

> <PUBCHEM_CACTVS_TPSA>
108

> <PUBCHEM_MONOISOTOPIC_WEIGHT>
202.04420454

> <PUBCHEM_TOTAL_CHARGE>
0

> <PUBCHEM_HEAVY_ATOM_COUNT>
12

> <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

> <PUBCHEM_BONDANNOTATIONS>
10  12  8
11  12  8
7  8  8
7  9  8
8  10  8
9  11  8

$$$$