Hydrazinecarbothioamide, 2-(3-oxo-3H-indol-2-yl)-N-phenyl-
Basic information
- CAS
70541-69-4- Standard SMILES
Oc1c(/N=N/C(=S)Nc2ccccc2)[nH]c2ccccc12- InChIKey
KUXGDDQHFXOXLZ-VHEBQXMUSA-N- Molecular formula
- C15H12N4OS
- Average molar mass
- 296.3 g/mol
- Monoisotopic mass
- 296.07318219
Names & identifiers
- Preferred name
- Hydrazinecarbothioamide, 2-(3-oxo-3H-indol-2-yl)-N-phenyl-
- IUPAC
- (1E)-1-[(3-hydroxy-1H-indol-2-yl)imino]-3-phenylthiourea
Names & synonyms
DTXSID204218792-(3-Oxo-3H-indol-2-yl)-N-phenylhydrazine-1-carbothioamideHydrazinecarbothioamide, 2-(3-oxo-3H-indol-2-yl)-N-phenyl-
Database identifiers
- CAS
70541-69-4- PubChem CID
- 135799331
- DTXSID
DTXSID20421879- Nikkaji
- J911.597H
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 105 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 397
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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