Basic information
- CAS
5947-53-5- Standard SMILES
COc1ccccc1NC(=O)CSC(N)=O- InChIKey
WZDOMPZYPBKCOE-UHFFFAOYSA-N- Molecular formula
- C10H12N2O3S
- Average molar mass
- 240.28 g/mol
- Monoisotopic mass
- 240.05686342
Overview
Carbamothioic acid S-[2-(2-methoxyanilino)-2-oxoethyl] ester is an anilide.
Names & identifiers
- Preferred name
- carbamothioic acid S-[2-(2-methoxyanilino)-2-oxoethyl] ester
- IUPAC
- S-[2-(2-methoxyanilino)-2-oxoethyl] carbamothioate
- English name
- Carbamic acid (8CI), thio-, S-ester with 2-mercapto-o-acetanisidide
- Molecular weight
- 0
Names & synonyms
7451-60-7S-[2-(2-methoxyanilino)-2-oxoethyl] carbamothioatecarbamothioic acid S-[2-(2-methoxyanilino)-2-oxoethyl] esterMLS000533449SMR000140887Carbamic acid (8CI), thio-, S-ester with 2-mercapto-o-acetanisidideS-{2-[(2-methoxyphenyl)amino]-2-oxoethyl} thiocarbamate5947-53-5NSC13801CBMicro_009633o-Acetanisidide, carbamateS-[2-(2-methoxyanilino)-2-oxoethyl] thiocarbamate
Show more names
cid_224935CHEMBL1367909SCHEMBL12127423BDBM44876DTXSID60279715CHEBI:112163HMS2171L12HMS3313O22
Database identifiers
- CAS
5947-53-5、7451-60-7- PubChem CID
- 224935
- DTXSID
DTXSID60279715- ChEMBL
CHEMBL1367909- ChEBI
CHEBI:112163
Properties
Computed structural properties
- XLogP
- 1
- Topological polar surface area
- 107 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 260
Chemistry & industry
Suppliers1 total
HONEST JOY HOLDINGS LIMITED[email protected]
Additional notes
DefinitionChEBI: Carbamothioic acid S-[2-(2-methoxyanilino)-2-oxoethyl] ester is an anilide.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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