2-[1-oxo-1-[(2Z)-2-(pyridin-3-ylmethylidene)hydrazinyl]propan-2-yl]sulfanyl-N-[(E)-pyridin-3-ylmethylideneamino]propanamide
Basic information
- CAS
6970-69-0- Standard SMILES
CC(SC(C)C(=O)N/N=C/c1cccnc1)C(=O)N/N=C\c1cccnc1- InChIKey
KLEBRGPHTATJPG-ZCJKAFFOSA-N- Molecular formula
- C18H20N6O2S
- Average molar mass
- 384.5 g/mol
- Monoisotopic mass
- 384.13684508
Names & identifiers
- Preferred name
- 2-[1-oxo-1-[(2Z)-2-(pyridin-3-ylmethylidene)hydrazinyl]propan-2-yl]sulfanyl-N-[(E)-pyridin-3-ylmethylideneamino]propanamide
- IUPAC
- 2-[1-oxo-1-[(2Z)-2-(pyridin-3-ylmethylidene)hydrazinyl]propan-2-yl]sulfanyl-N-[(E)-pyridin-3-ylmethylideneamino]propanamide
Names & synonyms
6970-69-0NSC62052NSC-62052
Database identifiers
- CAS
6970-69-0- PubChem CID
- 54599385
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 134 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 8
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 496
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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