Chemical Components in the PDB

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0VX : Summary

Code

0VX

One-letter code

X

Molecule name

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

Systematic names

ProgramVersionName
ACDLabs 12.01 N-[(2Z)-1,3-oxazolidin-2-ylidene]sulfuric diamide
OpenEye OEToolkits 1.7.6 (2Z)-2-sulfamoylimino-1,3-oxazolidine

Formula

C3 H7 N3 O3 S

Formal charge

0

Molecular weight

165.171 Da

SMILES

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

IUPAC InChI

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

IUPAC InChI key

DZVNFECQEPNTMT-UHFFFAOYSA-N
0VX

wwPDB Information

Atom count

17 (10 without Hydrogen)

Polymer type

Bound ligand

Type description

NON-POLYMER

Type code

HETAIN

Is modified

No

Standard parent

Not Assigned

Defined at

2012-07-15

Last modified at

2013-07-12

Status

Released

Obsoleted

Not Assigned