SEQ2FUN

BioLiP

PDB CCD ID: A1CVI
Number of entries in BioLiP: 2
Chemical formula: C5 H5 N O S
InChI: InChI=1S/C5H5NOS/c6-5(7)4-2-1-3-8-4/h1-3H,(H2,6,7)
InChIKey: DENPQNAWGQXKCU-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
CACTVS 3.385NC(=O)c1sccc1
OpenEye OEToolkits 3.1.0.0c1cc(sc1)C(=O)N
ACDLabs 14.52NC(=O)c1cccs1
Name:thiophene-2-carboxamide
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).