SVI

(4S)-[1,2,4]triazolo[4,3-a]pyrazine

Created:	2023-08-28
Last modified:	2023-11-29

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1 entries where SVI is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	13
Chiral Atom Count	0
Bond Count	14
Aromatic Bond Count	10

2D diagram of SVI

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Chemical Component Summary
Name	(4S)-[1,2,4]triazolo[4,3-a]pyrazine
Systematic Name (OpenEye OEToolkits)	[1,2,4]triazolo[4,3-a]pyrazine
Formula	C₅ H₄ N₄
Molecular Weight	120.112
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	12.01	c1cncc2nncn12
SMILES	CACTVS	3.385	c1cn2cnnc2cn1
SMILES	OpenEye OEToolkits	2.0.7	c1cn2cnnc2cn1
Canonical SMILES	CACTVS	3.385	c1cn2cnnc2cn1
Canonical SMILES	OpenEye OEToolkits	2.0.7	c1cn2cnnc2cn1
InChI	InChI	1.06	InChI=1S/C5H4N4/c1-2-9-4-7-8-5(9)3-6-1/h1-4H
InChIKey	InChI	1.06	NVSPJDGXKBDYIZ-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
PubChem	249778

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.