Basic information
- CAS
1919-69-3- Standard SMILES
NC(=S)NN=C1CSSC1- InChIKey
VXRHDGKBDCVXBW-UHFFFAOYSA-N- Molecular formula
- C4H7N3S3
- Average molar mass
- 193.3 g/mol
- Monoisotopic mass
- 192.98021076
Names & identifiers
- Preferred name
- 2-(1,2-Dithiolan-4-ylidene)hydrazinecarbothioamide
- IUPAC
- (dithiolan-4-ylideneamino)thiourea
Names & synonyms
Phenyl 800/181,2-DITHIOLAN-4-ONE, THIOSEMICARBAZONE1919-69-3PH 800/187LXK85BY2X2-(1,2-Dithiolan-4-ylidene)hydrazinecarbothioamideHydrazinecarbothioamide, 2-(1,2-dithiolan-4-ylidene)-NSC-72269NSC-208746DTXSID60172737RefChem:1060604DTXCID3095228
Show more names
(dithiolan-4-ylideneamino)thioureaMLS003107220NSC208746SMR001822095NSC 722691,2-Dithiolanon-4-thiosemicarbazoneNSC 208746UNII-7LXK85BY2X
Database identifiers
- CAS
1919-69-3- PubChem CID
- 3000655
- DTXSID
DTXSID60172737- ChEMBL
CHEMBL1887807- UNII
- 7LXK85BY2X
Properties
Computed structural properties
- XLogP
- 0.4
- Topological polar surface area
- 133 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 159
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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