Basic information
- Standard SMILES
CCc1cc(C)cc(CC)c1C(=O)C(=O)N(C)N=C(C)CS(C)(=O)=O- InChIKey
ILQNRBZBJYAXGE-UHFFFAOYSA-N- Molecular formula
- C18H26N2O4S
- Average molar mass
- 366.5 g/mol
- Monoisotopic mass
- 366.16132849
Names & identifiers
- Preferred name
- 1-[2-(2,6-Diethyl-4-methylphenyl)-2-oxoacetyl]-1-methyl-2-(1-methylsulfonyl-2-propylidene)hydrazine
- IUPAC
- 2-(2,6-diethyl-4-methylphenyl)-N-methyl-N-(1-methylsulfonylpropan-2-ylideneamino)-2-oxoacetamide
Names & synonyms
SCHEMBL15063712ILQNRBZBJYAXGE-UHFFFAOYSA-N1-[2-(2,6-diethyl-4-methylphenyl)-2-oxoacetyl]-1-methyl-2-(1-methylsulfonyl-2-propylidene)hydrazine
Database identifiers
- PubChem CID
- 76468960
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 92.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 7
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 607
Related reactions
10 records
Compound notes
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