BioLiP

PDB

BioLiP

PDB CCD ID:

9UT

Number of entries in BioLiP:

Chemical formula:

C3 H3 N O2 S

InChI:

InChI=1S/C3H3NO2S/c5-2-1-7-3(6)4-2/h1,7H,(H,4,5,6)

InChIKey:

OKCMWAHWBYXJPD-UHFFFAOYSA-N

SMILES:

Software	SMILES
CACTVS 3.385	O=C1NC(=O)[SH]=C1
OpenEye OEToolkits 2.0.6	C1=SC(=O)NC1=O

Name:

1,3-thiazole-2,4-dione

Reference:

Chengxin Zhang, Xi Zhang, Lydia Freddolino, and Yang Zhang. BioLiP2: an updated structure database for biologically relevent ligand-protein interactions, Nucleic Acids Research, gkad630 (2023).

Jianyi Yang, Ambrish Roy, and Yang Zhang. BioLiP: a semi-manually curated database for biologically relevant ligand-protein interactions, Nucleic Acids Research, 41: D1096-D1103 (2013) (download the PDF file).