| CAS Number | 2088499-23-2 |
| Catalog Number | AG01DTCP |
| Chemical Name | sodium {[2-(dimethylamino)ethyl]carbamothioyl}sulfanide |
| IUPAC Name | sodium;N-[2-(dimethylamino)ethyl]carbamodithioate |
| InChI | InChI=1S/C5H12N2S2.Na/c1-7(2)4-3-6-5(8)9;/h3-4H2,1-2H3,(H2,6,8,9);/q;+1/p-1 |
| InChI Key | OXTIFCKGNPYWNW-UHFFFAOYSA-M |
| MDL Number | MFCD31558901 |
| Molecular Formula | C5H11N2NaS2 |
| Molecular Weight | 186.274 |
| SMILES | [Na+].CN(CCNC([S-])=S)C |
| Synonyms | CHEMBL3967505,
sodium (2-(dimethylamino)ethyl)carbamodithioate,
2088499-23-2,
BDBM50207846,
|
| Complexity | 97.6 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 186.026g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 186.267g/mol |
| Monoisotopic Mass | 186.026g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 48.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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