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5-Amino-N-methanethioyl-1,2,3-thiadiazole-4-carbothioamide

HCID 3963471
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Basic information

CAS
79248-10-5
Standard SMILES
Nc1snnc1C(=S)NC=S
InChIKey
MARJHXIEKORNGX-UHFFFAOYSA-N
Molecular formula
C4H4N4S3
Average molar mass
204.3 g/mol
Monoisotopic mass
203.95980967

Names & identifiers

Preferred name
5-Amino-N-methanethioyl-1,2,3-thiadiazole-4-carbothioamide
IUPAC
5-amino-N-methanethioylthiadiazole-4-carbothioamide

Names & synonyms

79248-10-5NSC353095DTXSID103982635-Amino-N-methanethioyl-1,2,3-thiadiazole-4-carbothioamideNSC-353095

Database identifiers

CAS
79248-10-5
PubChem CID
3963471
DTXSID
DTXSID10398263

Properties

Computed structural properties

XLogP
1.2
Topological polar surface area
156 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
6
Rotatable bonds
1
Heavy atoms
11
Formal charge
0
Complexity
173

Related reactions

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Compound notes

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