Basic information
- CAS
71796-73-1- Standard SMILES
CCOc1cccc2cc(C(N)=S)c(=N)oc12- InChIKey
PCGDBSIFUSNVRD-UHFFFAOYSA-N- Molecular formula
- C12H12N2O2S
- Average molar mass
- 248.3 g/mol
- Monoisotopic mass
- 248.0619488
Names & identifiers
- Preferred name
- 8-Ethoxy-2-imino-2H-chromene-3-carbothioamide
- IUPAC
- 8-ethoxy-2-iminochromene-3-carbothioamide
Names & synonyms
71796-73-18-Ethoxy-2-imino-2H-chromene-3-carbothioamideDTXSID00358730RefChem:311992DTXCID803097852H-1-Benzopyran-3-carbothioamide, 8-ethoxy-2-imino-8-ethoxy-2-iminochromene-3-carbothioamideOprea1_271008PCGDBSIFUSNVRD-UHFFFAOYSA-NAKOS022109294ST509931758-Ethoxy-2-imino-2H-chromene-3-carbothioamide #
Show more names
8-Ethoxy-2-imino-2H-1-benzopyran-3-carbothioamide2H-Benz[b]oxan-3-thiocarboxamide, 8-ethoxy-2-imino-amino(8-ethoxy-2-iminochromen-3-yl)methane-1-thioneF6660-1357
Database identifiers
- CAS
71796-73-1- PubChem CID
- 911802
- DTXSID
DTXSID00358730
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 100 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 368
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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