2-(ethylsulfonyl)-1H-benzimidazole

Substructure search Find similar structures

Basic information

CAS: 30192-40-6
Standard SMILES: CCS(=O)(=O)c1nc2ccccc2[nH]1
InChIKey: XIBYQDHWUOXOEU-UHFFFAOYSA-N
Molecular formula: C9H10N2O2S
Average molar mass: 210.26 g/mol
Monoisotopic mass: 210.04629874

Names & identifiers

Preferred name: 2-(ethylsulfonyl)-1H-benzimidazole
IUPAC: 2-ethylsulfonyl-1H-benzimidazole

Names & synonyms

30192-40-62-(ethylsulfonyl)-1H-benzimidazole2-ethylsulfonyl-1H-benzimidazole2-(ethanesulfonyl)-1H-1,3-benzodiazole2-(ethylsulfonyl)-1H-benzo[d]imidazole1H-benzimidazol-2-yl ethyl sulfoneNSC191955Oprea1_039022SCHEMBL13220098DTXSID303075342-(ethanesulfonyl)-1H-benzimidazoleAKOS003573682

Show more names

NSC-1919552-(Ethanesulfonyl)-1H-1,3-benzimidazoleEN300-236466AR-422/41202490F2158-0371

Database identifiers

CAS: 30192-40-6
PubChem CID: 303541
DTXSID: DTXSID30307534

Properties

Computed structural properties

XLogP: 1.2
Topological polar surface area: 71.2 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 3
Rotatable bonds: 2
Heavy atoms: 14
Formal charge: 0
Complexity: 296

Related reactions

0 records

New reaction record

No reaction records under the current filter.

Compound notes

Loading…