RYM

4-(benzimidazol-1-ylmethyl)benzenecarbonitrile

Created: 2020-03-02
Last modified:  2020-07-01

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Chemical Details

Formal Charge0
Atom Count29
Chiral Atom Count0
Bond Count31
Aromatic Bond Count16
2D diagram of RYM

Chemical Component Summary

Name4-(benzimidazol-1-ylmethyl)benzenecarbonitrile
Systematic Name (OpenEye OEToolkits)4-(benzimidazol-1-ylmethyl)benzenecarbonitrile
FormulaC15 H11 N3
Molecular Weight233.268
TypeNON-POLYMER

Chemical Descriptors

TypeProgram Version Descriptor
SMILESCACTVS3.385N#Cc1ccc(Cn2cnc3ccccc23)cc1
SMILESOpenEye OEToolkits2.0.6c1ccc2c(c1)ncn2Cc3ccc(cc3)C#N
Canonical SMILESCACTVS3.385 N#Cc1ccc(Cn2cnc3ccccc23)cc1
Canonical SMILESOpenEye OEToolkits2.0.6 c1ccc2c(c1)ncn2Cc3ccc(cc3)C#N
InChIInChI1.03 InChI=1S/C15H11N3/c16-9-12-5-7-13(8-6-12)10-18-11-17-14-3-1-2-4-15(14)18/h1-8,11H,10H2
InChIKeyInChI1.03 KZMYEQMVROHICO-UHFFFAOYSA-N

Related Resource References

Resource NameReference
PubChem 863558