Basic information
- Standard SMILES
CC(=O)c1csc(Cn2ncc(NC(=O)c3nc(C)oc3-c3cccc(C)c3)n2)n1- InChIKey
SKHZCMTUZFBTQR-UHFFFAOYSA-N- Molecular formula
- C20H18N6O3S
- Average molar mass
- 422.5 g/mol
Names & identifiers
- Preferred name
- N-(2-((4-acetylthiazol-2-yl)methyl)-2H-1,2,3-triazol-4-yl)-2-methyl-5-(m-tolyl)oxazole-4-carboxamide
- IUPAC
- N-[2-[(4-acetyl-1,3-thiazol-2-yl)methyl]triazol-4-yl]-2-methyl-5-(3-methylphenyl)-1,3-oxazole-4-carboxamide
Names & synonyms
SCHEMBL2326964SKHZCMTUZFBTQR-UHFFFAOYSA-N2-Methyl-5-m-tolyl-oxazole-4-carboxylic acid [2-(4-acetyl-thiazol-2-ylmethyl)-2H-[1,2,3]triazol-4-yl]-amideN-(2-((4-acetylthiazol-2-yl)methyl)-2H-1,2,3-triazol-4-yl)-2-methyl-5-(m-tolyl)oxazole-4-carboxamide
Database identifiers
- PubChem CID
- 42644151
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 144 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 6
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 640
Related reactions
2 records
Compound notes
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