-OEChem-10281115202D

  7  7  0     0  0  0  0  0  0999 V2000
    2.1102    0.0000    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000   -1.0774    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    4.4520   -2.5243    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1102   -2.1548    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.3311   -1.0774    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3746   -1.7407    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3746   -0.4140    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  5  1  0  0  0  0
  1  7  1  0  0  0  0
  2  5  2  0  0  0  0
  3  6  2  0  0  0  0
  4  5  1  0  0  0  0
  4  6  1  0  0  0  0
  6  7  1  0  0  0  0
M  END
> <PUBCHEM_COMPOUND_ID_TYPE>
0

> <PUBCHEM_TOTAL_CHARGE>
0

> <PUBCHEM_SUBSTANCE_ID>
48424046

> <PUBCHEM_SUBSTANCE_VERSION>
2

> <PUBCHEM_EXT_DATASOURCE_NAME>
EPA DSSTox

> <PUBCHEM_EXT_DATASOURCE_REGID>
32011

> <PUBCHEM_SUBSTANCE_COMMENT>
Substance included in EPA DSSTox NTPBSI: National Toxicology Program (NTP) Bioassay On-line Database Structure-Index Locator File <a href="http://www.epa.gov/ncct/dsstox/sdf_ntpbsi.html"target="_blank">[link to DSSTox SDF Download Page]</a>
Structure Shown: tested chemical
For further information visit the NTP Study <a href="http://ntp-apps.niehs.nih.gov/ntp_tox/index.cfm?fuseaction=ntpsearch.ntpstudiesforchemical&cas_no=141-84-4"target="_blank">Chemical Results Webpage</a>

> <PUBCHEM_SUBSTANCE_SYNONYM>
141-84-4
2-thioxo-1,3-thiazolidin-4-one
Rhodanine

> <PUBCHEM_GENERIC_REGISTRY_NAME>
141-84-4

> <PUBCHEM_XREF_EXT_ID>
32011

> <PUBCHEM_EXT_DATASOURCE_URL>
http://www.epa.gov/ncct/dsstox/sdf_ntpbsi.html

> <PUBCHEM_EXT_SUBSTANCE_URL>
http://ntp-apps.niehs.nih.gov/ntp_tox/index.cfm?fuseaction=ntpsearch.ntpstudiesforchemical&cas_no=141-84-4

> <PUBCHEM_CID_ASSOCIATIONS>
1201546  1

> <PUBCHEM_COORDINATE_TYPE>
1
3

$$$$