Basic information
- Standard SMILES
CSC(N)=C(C#N)C#N- InChIKey
GSJVFTMCJWHRNL-UHFFFAOYSA-N- Molecular formula
- C5H5N3S
- Average molar mass
- 139.18 g/mol
Names & identifiers
- Preferred name
- 2-(Amino(methylthio)methylene)malononitrile
- IUPAC
- 2-[amino(methylsulfanyl)methylidene]propanedinitrile
Names & synonyms
18071-20-02-(AMINO(METHYLTHIO)METHYLENE)MALONONITRILE2-[amino(methylsulfanyl)methylidene]propanedinitrileMFCD04070729Propanedinitrile, 2-[amino(methylthio)methylene]-2-[Amino(methylthio)methylene]malononitrileamino-(methylmercapto)-methylenemalononitrilePropanedinitrile, [amino(methylthio)methylene]-3-amino-2-cyano-3-(methylthio)propenenitrileSCHEMBL11222290GSJVFTMCJWHRNL-UHFFFAOYSA-NBBL030211
Show more names
AKOS006339147AS-68122SY259191DB-186731CS-0303845[amino(methylsulfanyl)methylidene]propanedinitrile2-[amino(methylsulfanyl)methylene]propanedinitrileF473606
Database identifiers
- PubChem CID
- 4409233
- Nikkaji
- J1.826.622I
Properties
Computed structural properties
- XLogP
- 0.2
- Topological polar surface area
- 98.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 205
Related reactions
5 records
Compound notes
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