Basic information
- Standard SMILES
Cc1cc(C(N)=O)ccc1N=C1SC[C@H](CC(C)C)N1CC(C)C- InChIKey
CABFRALQLYZVFO-INIZCTEOSA-N- Molecular formula
- C19H29N3OS
- Average molar mass
- 347.5 g/mol
Names & identifiers
- Preferred name
- (4S)-2-(4-carbamoyl-2-methylphenylimino)-3,4-diisobutyl-1,3-thiazolidine
- IUPAC
- 4-[[(4S)-3,4-bis(2-methylpropyl)-1,3-thiazolidin-2-ylidene]amino]-3-methylbenzamide
Names & synonyms
SCHEMBL7112490SCHEMBL7112493CABFRALQLYZVFO-INIZCTEOSA-N(4S)-2-(4-carbamoyl-2-methylphenylimino)-3,4-diisobutyl-1,3-thiazolidine
Database identifiers
- PubChem CID
- 57123763
Properties
Computed structural properties
- XLogP
- 4.6
- Topological polar surface area
- 84 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 464
Related reactions
1 records
Compound notes
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