Basic information
- Standard SMILES
CCSc1ccc(NC(=S)NC(=O)OC)c(NC(=O)CN(C)C)c1- InChIKey
SJLBZMWUTBSERP-UHFFFAOYSA-N- Molecular formula
- C15H22N4O3S2
- Average molar mass
- 370.5 g/mol
Names & identifiers
- Preferred name
- 4-Ethylthio-1-(3-methoxycarbonyl-2-thioureido)-2-(2-dimethylaminoacetamido)benzene
- IUPAC
- methyl N-[[2-[[2-(dimethylamino)acetyl]amino]-4-ethylsulfanylphenyl]carbamothioyl]carbamate
Names & synonyms
SJLBZMWUTBSERP-UHFFFAOYSA-N4-ethylthio-1-(3-methoxycarbonyl-2-thioureido)-2-(2-dimethylaminoacetamido)benzene
Database identifiers
- PubChem CID
- 20372016
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 140 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 7
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 448
Related reactions
3 records
Compound notes
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