Ethyl 2-{[(benzoylamino)carbothioyl]amino}-4-methyl-1,3-thiazole-5-carboxylate
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Basic information
- CAS
83584-24-1- Standard SMILES
CCOC(=O)c1sc(NC(=S)NC(=O)c2ccccc2)nc1C- InChIKey
QCLUTUKTOMHQHT-UHFFFAOYSA-N- Molecular formula
- C15H15N3O3S2
- Average molar mass
- 349.4 g/mol
Names & identifiers
- Preferred name
- Ethyl 2-{[(benzoylamino)carbothioyl]amino}-4-methyl-1,3-thiazole-5-carboxylate
- IUPAC
- ethyl 2-(benzoylcarbamothioylamino)-4-methyl-1,3-thiazole-5-carboxylate
- English name
- ethyl 2-{[(benzoylamino)carbothioyl]amino}-4-methyl-1,3-thiazole-5-carboxylate
- Molecular formula
- C15H15N3O3S2
- Molecular weight
- 349.4279
Names & synonyms
ethyl 2-{[(benzoylamino)carbothioyl]amino}-4-methyl-1,3-thiazole-5-carboxylateOprea1_255616MLS000712404CHEMBL1335336HMS2698M13STK973364AKOS000522374ethyl 2-(benzoylcarbamothioylamino)-4-methyl-1,3-thiazole-5-carboxylateSMR000282171AF-886/31411042AG-690/12889064ethyl 4-methyl-2-{[(phenylcarbonyl)carbamothioyl]amino}-1,3-thiazole-5-carboxylate
Database identifiers
- CAS
83584-24-1- ChEMBL
CHEMBL1335336
Properties
Computed structural propertiesFilling in
- XLogP
- 3.8
- Topological polar surface area
- 141 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 455
Related reactions
0 records
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Compound notes
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