3-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]propanenitrile

CAS: 21116-02-9

Molecular Formula	`C5H6N4S2`
Molecular Weight	186.3 g/mol
LogP	0.6
Topological Polar Surface Area	129.0 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	6
Rotatable Bonds	3
Exact Mass	186.00339
Heavy Atoms	11
Complexity	165.0

Chemical Identifiers

CAS Number	21116-02-9
SMILES	`C(CSC1=NN=C(S1)N)C#N`
InChIKey	`HLDNUXTVHFSSCK-UHFFFAOYSA-N`

📖 Product Overview

3-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]propanenitrile (CAS: 21116-02-9) is a chemical compound with molecular formula C5H6N4S2 and molecular weight 186.3 g/mol. Its IUPAC systematic name is 3-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]propanenitrile. LogP 0.6 Topological Polar Surface Area 129.0 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 6 Rotatable Bonds 3 Exact Mass 186.00339 Heavy Atoms 11 Complexity 165.0 InChI Key: HLDNUXTVHFSSCK-UHFFFAOYSA-N. SMILES: C(CSC1=NN=C(S1)N)C#N.

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