N-(pyridin-2-yl)-5-thiocyanatothiazol-2-amine

HCID 59200440
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Basic information

Standard SMILES
N#CSc1cnc(Nc2ccccn2)s1
InChIKey
ZVDQSBFHEJKBHL-UHFFFAOYSA-N
Molecular formula
C9H6N4S2
Average molar mass
234.3 g/mol
Monoisotopic mass
234.00338856

Names & identifiers

Preferred name
N-(pyridin-2-yl)-5-thiocyanatothiazol-2-amine
IUPAC
[2-(pyridin-2-ylamino)-1,3-thiazol-5-yl] thiocyanate

Names & synonyms

SCHEMBL2067788ZVDQSBFHEJKBHL-UHFFFAOYSA-NN-(pyridin-2-yl)-5-thiocyanatothiazol-2-amine

Database identifiers

PubChem CID
59200440

Properties

Computed structural properties

XLogP
3
Topological polar surface area
115 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
6
Rotatable bonds
3
Heavy atoms
15

Related reactions

3 records
New reaction record

Compound notes

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