BioLiP

PDB

BioLiP

PDB CCD ID:

0VX

Number of entries in BioLiP:

Chemical formula:

C3 H7 N3 O3 S

InChI:

InChI=1S/C3H7N3O3S/c4-10(7,8)6-3-5-1-2-9-3/h1-2H2,(H,5,6)(H2,4,7,8)

InChIKey:

DZVNFECQEPNTMT-UHFFFAOYSA-N

SMILES:

Software	SMILES
CACTVS 3.370	N[S](=O)(=O)N=C1NCCO1
ACDLabs 12.01	O=S(=O)(/N=C1\OCCN1)N
OpenEye OEToolkits 1.7.6	C1COC(=NS(=O)(=O)N)N1
OpenEye OEToolkits 1.7.6	C1CO/C(=N\S(=O)(=O)N)/N1

Name:

N-[(2Z)-1,3-oxazolidin-2-ylidene]sulfuric diamide

ZINC:

ZINC000039121673

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).