M75

~{N}-cyclopropyl-1~{H}-imidazole-4-sulfonamide

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

Find Related PDB Entry
1 entries where M75 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	21
Chiral Atom Count	0
Bond Count	22
Aromatic Bond Count	5

2D diagram of M75

Toggle Hydrogen Toggle Labels

Chemical Component Summary
Name	~{N}-cyclopropyl-1~{H}-imidazole-4-sulfonamide
Systematic Name (OpenEye OEToolkits)	~{N}-cyclopropyl-1~{H}-imidazole-4-sulfonamide
Formula	C₆ H₉ N₃ O₂ S
Molecular Weight	187.22
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	CACTVS	3.385	O=[S](=O)(NC1CC1)c2c[nH]cn2
SMILES	OpenEye OEToolkits	2.0.7	c1c(nc[nH]1)S(=O)(=O)NC2CC2
Canonical SMILES	CACTVS	3.385	O=[S](=O)(NC1CC1)c2c[nH]cn2
Canonical SMILES	OpenEye OEToolkits	2.0.7	c1c(nc[nH]1)S(=O)(=O)NC2CC2
InChI	InChI	1.03	InChI=1S/C6H9N3O2S/c10-12(11,9-5-1-2-5)6-3-7-4-8-6/h3-5,9H,1-2H2,(H,7,8)
InChIKey	InChI	1.03	JRINQCODSFQXLT-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
PubChem	54593460

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.