M6Z

5-iodanyl-~{N}-methyl-1~{H}-indazole-3-carboxamide

Created: 2019-10-03
Last modified:  2020-03-04

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Chemical Details

Formal Charge0
Atom Count22
Chiral Atom Count0
Bond Count23
Aromatic Bond Count10
2D diagram of M6Z

Chemical Component Summary

Name5-iodanyl-~{N}-methyl-1~{H}-indazole-3-carboxamide
Systematic Name (OpenEye OEToolkits)5-iodanyl-~{N}-methyl-1~{H}-indazole-3-carboxamide
FormulaC9 H8 I N3 O
Molecular Weight301.084
TypeNON-POLYMER

Chemical Descriptors

TypeProgram Version Descriptor
SMILESCACTVS3.385CNC(=O)c1n[nH]c2ccc(I)cc12
SMILESOpenEye OEToolkits2.0.7CNC(=O)c1c2cc(ccc2[nH]n1)I
Canonical SMILESCACTVS3.385 CNC(=O)c1n[nH]c2ccc(I)cc12
Canonical SMILESOpenEye OEToolkits2.0.7 CNC(=O)c1c2cc(ccc2[nH]n1)I
InChIInChI1.03 InChI=1S/C9H8IN3O/c1-11-9(14)8-6-4-5(10)2-3-7(6)12-13-8/h2-4H,1H3,(H,11,14)(H,12,13)
InChIKeyInChI1.03 RJUNKUYOTNQVNF-UHFFFAOYSA-N

Related Resource References

Resource NameReference
PubChem 75422753
ChEMBL CHEMBL3467551