TP5

THIOPHENE-3-CARBOXIMIDAMIDE

Created:	2005-09-13
Last modified:	2011-06-04

Find Related PDB Entry
4 entries where TP5 is found as a standalone ligand

Find related ligands:

Similar Ligands (Stereospecific) Similar Ligands (including Stereoisomers) Similar Ligands (Quick Screen) Similar Ligands (Substructure Stereospecific) Similar Ligands (Substructure including Stereoisomers)

Chemical Details
Formal Charge	0
Atom Count	14
Chiral Atom Count	0
Bond Count	14
Aromatic Bond Count	5

2D diagram of TP5

Toggle Hydrogen Toggle Labels

Chemical Component Summary
Name	THIOPHENE-3-CARBOXIMIDAMIDE
Systematic Name (OpenEye OEToolkits)	thiophene-3-carboximidamide
Formula	C₅ H₆ N₂ S
Molecular Weight	126.18
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	10.04	[N@H]=C(N)c1ccsc1
SMILES	CACTVS	3.341	NC(=N)c1cscc1
SMILES	OpenEye OEToolkits	1.5.0	[H]N=C(c1ccsc1)N
Canonical SMILES	CACTVS	3.341	NC(=N)c1cscc1
Canonical SMILES	OpenEye OEToolkits	1.5.0	[H]/N=C(\c1ccsc1)/N
InChI	InChI	1.03	InChI=1S/C5H6N2S/c6-5(7)4-1-2-8-3-4/h1-3H,(H3,6,7)
InChIKey	InChI	1.03	JKCKRNYECSTMLV-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
PubChem	2779693

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.