Basic information
- CAS
63467-76-5- Standard SMILES
CC(=O)Nc1cccc(NC(=S)[S-])c1.CC[NH+](CC)CC- InChIKey
UOCUCTZLFULNNO-UHFFFAOYSA-N- Molecular formula
- C15H25N3OS2
- Average molar mass
- 327.5 g/mol
- Monoisotopic mass
- 327.14390478
Overview
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Names & identifiers
- Preferred name
- N-(3-acetamidophenyl)carbamodithioate;triethylazanium
- IUPAC
- N-(3-acetamidophenyl)carbamodithioate;triethylazanium
Names & synonyms
DB-321809NS00054879
Database identifiers
- CAS
63467-76-5- PubChem CID
- 136249554
Properties
Computed structural properties
- Topological polar surface area
- 78.7 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 253
Related reactions
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Compound notes
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