Basic information
- Standard SMILES
Cc1cc(C2C=CCC2)c(S(C)(=O)=O)cc1C(=O)N=C(N)N- InChIKey
CGVDKYPZVVFXKO-UHFFFAOYSA-N- Molecular formula
- C15H19N3O3S
- Average molar mass
- 321.4 g/mol
Names & identifiers
- Preferred name
- N-diaminomethylene-2-methyl-4-(1-cyclopenten-3-yl)-5-methylsulfonylbenzamide
- IUPAC
- 4-cyclopent-2-en-1-yl-N-(diaminomethylidene)-2-methyl-5-methylsulfonylbenzamide
Names & synonyms
SCHEMBL7793133CGVDKYPZVVFXKO-UHFFFAOYSA-NN-diaminomethylene-2-methyl-4-(1-cyclopenten-3-yl)-5-methylsulfonylbenzamideN-diaminomethylene-2-methyl-4-(1-cyclopentene-3-yl)-5-methylsulfonylbenzamide
Database identifiers
- PubChem CID
- 9818569
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 124 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 588
Related reactions
4 records
Linked notes
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