2-(1H-benzimidazol-2-ylsulfanyl)-1-(2,3-dihydroindol-1-yl)ethanone
Basic information
- CAS
330829-56-6- Standard SMILES
O=C(CSc1nc2ccccc2[nH]1)N1CCc2ccccc21- InChIKey
SYWQRODITJACIX-UHFFFAOYSA-N- Molecular formula
- C17H15N3OS
- Average molar mass
- 309.4 g/mol
- Monoisotopic mass
- 309.09358328
Names & identifiers
- Preferred name
- 2-(1H-benzimidazol-2-ylsulfanyl)-1-(2,3-dihydroindol-1-yl)ethanone
- IUPAC
- 2-(1H-benzimidazol-2-ylsulfanyl)-1-(2,3-dihydroindol-1-yl)ethanone
Names & synonyms
330829-56-62-(1H-Benzimidazol-2-ylthio)-1-(2,3-dihydro-1H-indol-1-yl)ethanone2-{[2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl]thio}-1H-benzimidazole2-[(1H-Benzimidazol-2-yl)sulfanyl]-1-(2,3-dihydro-1H-indol-1-yl)ethan-1-oneOprea1_507563Oprea1_649634DTXSID3011640462-(1H-benzimidazol-2-ylsulfanyl)-1-(2,3-dihydroindol-1-yl)ethanoneCCG-53565STK0842002-(1H-benzimidazol-2-ylsulfanyl)-1-(2,3-dihydro-1H-indol-1-yl)ethanoneAKOS000623853
Show more names
ST507337912-benzimidazol-2-ylthio-1-indolinylethan-1-oneSR-01000459623SR-01000459623-1SR-01000459623-2BRD-K20771838-001-01-3Z196505162-((1H-benzo[d]imidazol-2-yl)thio)-1-(indolin-1-yl)ethanone
Database identifiers
- CAS
330829-56-6- PubChem CID
- 712220
- DTXSID
DTXSID301164046
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 74.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 419
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Compound notes
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