I1L

[2-(2~{H}-1,2,3,4-tetrazol-5-yl)ethanoylamino]azanium

Created: 2017-10-27
Last modified:  2019-02-20

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Chemical Details

Formal Charge1
Atom Count17
Chiral Atom Count0
Bond Count17
Aromatic Bond Count5
2D diagram of I1L

Chemical Component Summary

Name[2-(2~{H}-1,2,3,4-tetrazol-5-yl)ethanoylamino]azanium
Systematic Name (OpenEye OEToolkits)[2-(2~{H}-1,2,3,4-tetrazol-5-yl)ethanoylamino]azanium
FormulaC3 H7 N6 O
Molecular Weight143.127
TypeNON-POLYMER

Chemical Descriptors

TypeProgram Version Descriptor
SMILESCACTVS3.385[NH3+]NC(=O)Cc1n[nH]nn1
SMILESOpenEye OEToolkits2.0.6C(c1n[nH]nn1)C(=O)N[NH3+]
Canonical SMILESCACTVS3.385 [NH3+]NC(=O)Cc1n[nH]nn1
Canonical SMILESOpenEye OEToolkits2.0.6 C(c1n[nH]nn1)C(=O)N[NH3+]
InChIInChI1.03 InChI=1S/C3H6N6O/c4-5-3(10)1-2-6-8-9-7-2/h1,4H2,(H,5,10)(H,6,7,8,9)/p+1
InChIKeyInChI1.03 TWKUAKLZOIABHJ-UHFFFAOYSA-O

Related Resource References

Resource NameReference
PubChem 137332073