2,4-Bis(methylthio)imidazo[2,1-f][1,2,4]triazine-7-carbonitrile

HCID 71065375
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Basic information

Standard SMILES
CSc1nc(SC)c2ncc(C#N)n2n1
InChIKey
BYUUPGNORRDSQD-UHFFFAOYSA-N
Molecular formula
C8H7N5S2
Average molar mass
237.3 g/mol

Names & identifiers

Preferred name
2,4-Bis(methylthio)imidazo[2,1-f][1,2,4]triazine-7-carbonitrile
IUPAC
2,4-bis(methylsulfanyl)imidazo[2,1-f][1,2,4]triazine-7-carbonitrile

Names & synonyms

2,4-bis(methylthio)imidazo[2,1-f][1,2,4]triazine-7-carbonitrile1062136-01-9SCHEMBL14078745BYUUPGNORRDSQD-UHFFFAOYSA-NDB-181622

Database identifiers

PubChem CID
71065375

Properties

Computed structural properties

XLogP
1.4
Topological polar surface area
117 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
6
Rotatable bonds
2
Heavy atoms
15

Related reactions

8 records
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Compound notes

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