Basic information
- CAS
50435-25-1- Standard SMILES
Cc1cc(Cl)ccc1N=C1SCS1- InChIKey
XYJUOQPINFXBEZ-UHFFFAOYSA-N- Molecular formula
- C9H8ClNS2
- Average molar mass
- 229.8 g/mol
- Monoisotopic mass
- 228.9786693
Overview
Nimidane is a small molecule drug. Nimidane has a monoisotopic molecular weight of 228.98 Da.
Names & identifiers
- Preferred name
- Nimidane
- IUPAC
- N-(4-chloro-2-methylphenyl)-1,3-dithietan-2-imine
- English name
- Nimidane
- Molecular formula
- C9H8ClNS2
- Molecular weight
- 229.75
Names & synonyms
Nimidane50435-25-1NimidanoN-(4-chloro-2-methylphenyl)-1,3-dithietan-2-imineENT 29,106CL 84,633ENT-29106J3YYF867DVCL-84633Cyclic methylene (4-chloro-o-tolyl)dithioimidocarbonateBenzeneamine, 4-chloro-N-1,3-dithietan-2-ylidene-2-methyl-Nimidanum
Show more names
Abequito4-Chloro-N-(1,3-dithietan-2-ylidene)-2-methylbenzenamineBenzenamine, 4-chloro-N-1,3-dithietan-2-ylidene-2-methyl-
Nimidano [INN-Spanish]Nimidane [USAN:INN]Nimidanum [INN-Latin]UNII-J3YYF867DVNIMIDANE [USAN]Nimidane (USAN/INN)NIMIDANE [INN]AI3-29106
Database identifiers
- CAS
50435-25-1- PubChem CID
- 65440
- DTXSID
DTXSID60198472- ChEMBL
CHEMBL93885- UNII
- J3YYF867DV
- Nikkaji
- J9.822A
Properties
Computed structural properties
- XLogP
- 4.6
- Topological polar surface area
- 63 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 214
Physicochemical properties
- Melting point
- 43 · 43-46°
- FDA UNII
- 3 YYF867DV · J3YYF867DV
Chemistry & industry
Applications
UsesAcaricide (veterinary).
Suppliers4 total
2A PharmaChem USA[email protected]
Leancare Ltd.[email protected]
Lanospharma Laboratories Co.,Ltd13440048448 · [email protected]
3B Scientific Corporation[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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