Basic information
- CAS
59375-71-2- Standard SMILES
CNC(=O)ON=C1SCCSC1C- InChIKey
UNTSPMCSYMCSNZ-UHFFFAOYSA-N- Molecular formula
- C7H12N2O2S2
- Average molar mass
- 220.3 g/mol
- Monoisotopic mass
- 220.03401998
Names & identifiers
- Preferred name
- [(3-methyl-1,4-dithian-2-ylidene)amino] N-methylcarbamate
- IUPAC
- [(3-methyl-1,4-dithian-2-ylidene)amino] N-methylcarbamate
Names & synonyms
DTXSID301032150[(3-methyl-1,4-dithian-2-ylidene)amino] N-methylcarbamate
Database identifiers
- CAS
59375-71-2- PubChem CID
- 43016
- DTXSID
DTXSID301032150
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 101 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 221
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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