9XZ

3-(2-methyltetrazol-5-yl)-5-(3-thienyl)pyridin-2-amine

Created:	2015-03-08
Last modified:	2015-05-13

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1 entries where 9XZ is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	28
Chiral Atom Count	0
Bond Count	30
Aromatic Bond Count	16

2D diagram of 9XZ

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Chemical Component Summary
Name	3-(2-methyltetrazol-5-yl)-5-(3-thienyl)pyridin-2-amine
Systematic Name (OpenEye OEToolkits)	3-(2-methyl-1,2,3,4-tetrazol-5-yl)-5-thiophen-3-yl-pyridin-2-amine
Formula	C₁₁ H₁₀ N₆ S
Molecular Weight	258.302
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	CACTVS	3.385	Cn1nnc(n1)c2cc(cnc2N)c3cscc3
SMILES	OpenEye OEToolkits	1.7.6	Cn1nc(nn1)c2cc(cnc2N)c3ccsc3
Canonical SMILES	CACTVS	3.385	Cn1nnc(n1)c2cc(cnc2N)c3cscc3
Canonical SMILES	OpenEye OEToolkits	1.7.6	Cn1nc(nn1)c2cc(cnc2N)c3ccsc3
InChI	InChI	1.03	InChI=1S/C11H10N6S/c1-17-15-11(14-16-17)9-4-8(5-13-10(9)12)7-2-3-18-6-7/h2-6H,1H3,(H2,12,13)
InChIKey	InChI	1.03	SYTWVNLAKXLKOD-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
PubChem	91754985

RCSB PDB Core Operations are funded by the U.S. National Science Foundation (DBI-2321666), the US Department of Energy (DE-SC0019749), and the National Cancer Institute, National Institute of Allergy and Infectious Diseases, and National Institute of General Medical Sciences of the National Institutes of Health under grant R01GM157729.