2-[(1-benzyl-6-oxo-1,6-dihydro-3-pyridinyl)carbonyl]-N-ethyl-1-hydrazinecarbothioamide
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Basic information
- CAS
242472-10-2- Standard SMILES
CCNC(=S)NNC(=O)c1ccc(=O)n(Cc2ccccc2)c1- InChIKey
LUHMAGRQMLKILS-UHFFFAOYSA-N- Molecular formula
- C16H18N4O2S
- Average molar mass
- 330.4 g/mol
- Monoisotopic mass
- 330.115047
Names & identifiers
- Preferred name
- 2-[(1-benzyl-6-oxo-1,6-dihydro-3-pyridinyl)carbonyl]-N-ethyl-1-hydrazinecarbothioamide
- IUPAC
- 1-[(1-benzyl-6-oxopyridine-3-carbonyl)amino]-3-ethylthiourea
- English name
- 2-[(1-BENZYL-6-OXO-1,6-DIHYDRO-3-PYRIDINYL)CARBONYL]-N-ETHYL-1-HYDRAZINECARBOTHIOAMIDE
- Molecular formula
- C16H18N4O2S
- Molecular weight
- 330.4
Names & synonyms
242472-10-22-[(1-benzyl-6-oxo-1,6-dihydro-3-pyridinyl)carbonyl]-N-ethyl-1-hydrazinecarbothioamide1-benzyl-N-[(ethylcarbamothioyl)amino]-6-oxo-1,6-dihydropyridine-3-carboxamideMFCD001406221-[(1-benzyl-6-oxopyridine-3-carbonyl)amino]-3-ethylthioureaMLS000694634CHEMBL1392156HMS2640D14AKOS00507423110E-387SSMR0003333021-[(1-benzyl-6-oxo-pyridine-3-carbonyl)amino]-3-ethyl-thiourea
Show more names
3-Pyridinecarboxylic acid, 1,6-dihydro-6-oxo-1-(phenylmethyl)-, 2-[(ethylamino)thioxomethyl]hydrazide
2-(1-Benzyl-6-oxo-1,6-dihydropyridine-3-carbonyl)-N-ethylhydrazine-1-carbothioamide
Database identifiers
- CAS
242472-10-2- PubChem CID
- 2764909
- ChEMBL
CHEMBL1392156
Properties
Computed structural propertiesFilling in
- XLogP
- 1.2
- Topological polar surface area
- 106 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 524
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Related reactions
0 records
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Compound notes
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