Chemical Components in the PDB

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ZON : Summary

Code

ZON

One-letter code

X

Molecule name

1-(1,2-benzoxazol-3-yl)methanesulfonamide

Synonyms

Zonisamide

Systematic names

ProgramVersionName
ACDLabs 12.01 1-(1,2-benzoxazol-3-yl)methanesulfonamide
OpenEye OEToolkits 1.7.0 1,2-benzoxazol-3-ylmethanesulfonamide

Formula

C8 H8 N2 O3 S

Formal charge

0

Molecular weight

212.226 Da

SMILES

TypeProgramVersionDescriptor
SMILES ACDLabs 12.01 O=S(=O)(N)Cc2noc1ccccc12
SMILES CACTVS 3.370 N[S](=O)(=O)Cc1noc2ccccc12
SMILES OpenEye OEToolkits 1.7.0 c1ccc2c(c1)c(no2)CS(=O)(=O)N
Canonical SMILES CACTVS 3.370 N[S](=O)(=O)Cc1noc2ccccc12
Canonical SMILES OpenEye OEToolkits 1.7.0 c1ccc2c(c1)c(no2)CS(=O)(=O)N

IUPAC InChI

InChI=1S/C8H8N2O3S/c9-14(11,12)5-7-6-3-1-2-4-8(6)13-10-7/h1-4H,5H2,(H2,9,11,12)

IUPAC InChI key

UBQNRHZMVUUOMG-UHFFFAOYSA-N
ZON

wwPDB Information

Atom count

22 (14 without Hydrogen)

Polymer type

Bound ligand

Type description

NON-POLYMER

Type code

HETAIN

Is modified

No

Standard parent

Not Assigned

Defined at

2010-11-26

Last modified at

2011-06-04

Status

Released

Obsoleted

Not Assigned