Basic information
- CAS
92126-28-8- Standard SMILES
CNC(=O)OCc1c(C)sc(-c2ccccc2)c1COC(=O)NC- InChIKey
ZEYMYXMSFOKUQF-UHFFFAOYSA-N- Molecular formula
- C17H20N2O4S
- Average molar mass
- 348.4 g/mol
- Monoisotopic mass
- 348.1143783
Names & identifiers
- Preferred name
- [2-methyl-4-(methylcarbamoyloxymethyl)-5-phenylthiophen-3-yl]methyl N-methylcarbamate
- IUPAC
- [2-methyl-4-(methylcarbamoyloxymethyl)-5-phenylthiophen-3-yl]methyl N-methylcarbamate
Names & synonyms
NSC34163492126-28-8[2-methyl-4-(methylcarbamoyloxymethyl)-5-phenylthiophen-3-yl]methyl N-methylcarbamateCHEMBL431716DTXSID30319197NSC-3416343,4-Thiophenedimethanol, 2-methyl-5-phenyl-, bis(methylcarbamate)(2-Methyl-5-phenylthiophene-3,4-diyl)bis(methylene) bis(methylcarbamate)[2-methyl-4-(methylcarbamoyloxymethyl)-5-phenyl-3-thienyl]methyl N-methylcarbamate
Database identifiers
- CAS
92126-28-8- PubChem CID
- 334789
- DTXSID
DTXSID30319197- ChEMBL
CHEMBL431716
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 105 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 7
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 429
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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