Basic information
- CAS
24539-87-5- Standard SMILES
O=S(=O)(NC(=S)Nc1ccccc1)c1ccccc1- InChIKey
DQZVRFYALJGUCL-UHFFFAOYSA-N- Molecular formula
- C13H12N2O2S2
- Average molar mass
- 292.4 g/mol
- Monoisotopic mass
- 292.03401998
Names & identifiers
- Preferred name
- N-(Benzenesulfonyl)-N'-phenylcarbamimidothioic acid
- IUPAC
- 1-(benzenesulfonyl)-3-phenylthiourea
- English name
- N-[Phenylamino(thioxo)methyl]benzenesulfonamide
- Molecular formula
- C13H12N2O2S2
- Molecular weight
- 292.38
Names & synonyms
24539-87-5DTXSID20947423N-(Benzenesulfonyl)-N'-phenylcarbamimidothioic acidRefChem:1091401DTXCID301375681N-Phenyl-N'-phenylsulfonylthiourean-(phenylcarbamothioyl)benzenesulfonamideN-[Phenylamino(thioxo)methyl]benzenesulfonamideUREA, 1-PHENYL-3-(PHENYLSULFONYL)-2-THIO-CHEMBL54230781-(benzenesulfonyl)-3-phenylthioureaOprea1_691280
Show more names
1-Phenyl-3-(phenylsulfonyl)thiourea
Benzenesulfonamide, N-[(phenylamino)thioxomethyl]-DQZVRFYALJGUCL-UHFFFAOYSA-NBDBM50625840AKOS002205457N-Phenyl- N'-benzolsulfonylthioharnstoffST50131420([(Anilinocarbothioyl)amino]sulfonyl)benzene #[(phenylamino)thioxomethyl](phenylsulfonyl)amine
Database identifiers
- CAS
24539-87-5- PubChem CID
- 726366
- DTXSID
DTXSID20947423- ChEMBL
CHEMBL5423078- Nikkaji
- J48.966B
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 98.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 391
Chemistry & industry
Suppliers1 total
北京福源坊科技有限公司010-57903446 15869909019 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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