Phencarbamide 1,5-naphthalenedisulfonate
Basic information
- CAS
1675-05-4- Standard SMILES
CCN(CC)CCSC(=O)N(c1ccccc1)c1ccccc1.O=S(=O)(O)c1cccc2c(S(=O)(=O)O)cccc12- InChIKey
ZZNARJBYZHRHKJ-UHFFFAOYSA-N- Molecular formula
- C29H32N2O7S3
- Average molar mass
- 616.8 g/mol
- Monoisotopic mass
- 616.13716488
Names & identifiers
- Preferred name
- Phencarbamide 1,5-naphthalenedisulfonate
- IUPAC
- S-[2-(diethylamino)ethyl] N,N-diphenylcarbamothioate;naphthalene-1,5-disulfonic acid
Names & synonyms
Phencarbamide napadisilateHXQ3ENP4FGPhencarbamid-ndsUNII-HXQ3ENP4FGPhencarbamide 1,5-naphthalenedisulfonateFENCARBAMIDE NAPHTHALENE DISULFONATEPHENCARBAMIDE NAPHTHALENEDISULFONATEPHENCARBAMIDE 1,5-NAPHTHALENEDISULFONATE [MI]S-(2-(Diethylamino)ethyl) diphenylthiocarbamate 1,5-naphthalenedisulfonateCarbamic acid, diphenylthio-, S-(2-(diethylamino)ethyl) ester, 1,5-naphthalenedisulfonateDiphenylcarbamothioic acid S-(2-(diethylamino)ethyl) ester 1,5-naphthalenedisulfonateDiphenylthiocarbamic acid S-(2-(diethylamino)ethyl) ester 1,5-naphthalenedisulfonate
Show more names
CARBAMOTHIOIC ACID, DIPHENYL-, S-(2-(DIETHYLAMINO)ETHYL) ESTER, 1,5-NAPHTHALENEDISULFONATECARBAMOTHIOIC ACID, DIPHENYL-, S-(2-(DIETHYLAMINO)ETHYL) ESTER, 1,5-NAPHTHALENEDISULFONATE (1:1)RefChem:202590DTXCID40144795DTXSID80222304GelosedineFencarbamide napadisilate72017-58-4
Database identifiers
- CAS
1675-05-4、72017-58-4- PubChem CID
- 20057134
- UNII
- HXQ3ENP4FG
Properties
Computed structural properties
- Topological polar surface area
- 174 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 10
- Heavy atoms
- 41
- Formal charge
- 0
- Complexity
- 766
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Compound notes
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