RHT

4-(3-methylbenzimidazol-5-yl)pyridine-2,6-diamine

Created: 2020-09-30
Last modified:  2021-05-26

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Chemical Details

Formal Charge0
Atom Count31
Chiral Atom Count0
Bond Count33
Aromatic Bond Count16
2D diagram of RHT

Chemical Component Summary

Name4-(3-methylbenzimidazol-5-yl)pyridine-2,6-diamine
Systematic Name (OpenEye OEToolkits)4-(3-methylbenzimidazol-5-yl)pyridine-2,6-diamine
FormulaC13 H13 N5
Molecular Weight239.276
TypeNON-POLYMER

Chemical Descriptors

TypeProgram Version Descriptor
SMILESCACTVS3.385Cn1cnc2ccc(cc12)c3cc(N)nc(N)c3
SMILESOpenEye OEToolkits2.0.7Cn1cnc2c1cc(cc2)c3cc(nc(c3)N)N
Canonical SMILESCACTVS3.385 Cn1cnc2ccc(cc12)c3cc(N)nc(N)c3
Canonical SMILESOpenEye OEToolkits2.0.7 Cn1cnc2c1cc(cc2)c3cc(nc(c3)N)N
InChIInChI1.03 InChI=1S/C13H13N5/c1-18-7-16-10-3-2-8(4-11(10)18)9-5-12(14)17-13(15)6-9/h2-7H,1H3,(H4,14,15,17)
InChIKeyInChI1.03 SOLATORCLYYKKR-UHFFFAOYSA-N

Related Resource References

Resource NameReference
PubChem 155920135