N6U

~{N}-(1~{H}-pyrrolo[2,3-b]pyridin-4-yl)ethanesulfonamide

Created: 2022-08-12
Last modified:  2024-09-27

Find related ligands:

Chemical Details

Formal Charge0
Atom Count26
Chiral Atom Count0
Bond Count27
Aromatic Bond Count10
2D diagram of N6U

Chemical Component Summary

Name~{N}-(1~{H}-pyrrolo[2,3-b]pyridin-4-yl)ethanesulfonamide
Systematic Name (OpenEye OEToolkits)~{N}-(1~{H}-pyrrolo[2,3-b]pyridin-4-yl)ethanesulfonamide
FormulaC9 H11 N3 O2 S
Molecular Weight225.268
TypeNON-POLYMER

Chemical Descriptors

TypeProgram Version Descriptor
SMILESCACTVS3.385CC[S](=O)(=O)Nc1ccnc2[nH]ccc12
SMILESOpenEye OEToolkits2.0.7CCS(=O)(=O)Nc1ccnc2c1cc[nH]2
Canonical SMILESCACTVS3.385 CC[S](=O)(=O)Nc1ccnc2[nH]ccc12
Canonical SMILESOpenEye OEToolkits2.0.7 CCS(=O)(=O)Nc1ccnc2c1cc[nH]2
InChIInChI1.06 InChI=1S/C9H11N3O2S/c1-2-15(13,14)12-8-4-6-11-9-7(8)3-5-10-9/h3-6H,2H2,1H3,(H2,10,11,12)
InChIKeyInChI1.06 KBQTUGASKMRCFK-UHFFFAOYSA-N

Related Resource References

Resource NameReference
PubChem 23515122