Chemical Components in the PDB

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NIZ : Summary

Code

NIZ

One-letter code

X

Molecule name

pyridine-4-carbohydrazide

Synonyms

isonicotinic acid hydrazid

Systematic names

ProgramVersionName
ACDLabs 12.01 pyridine-4-carbohydrazide
OpenEye OEToolkits 1.7.0 pyridine-4-carbohydrazide

Formula

C6 H7 N3 O

Formal charge

0

Molecular weight

137.139 Da

SMILES

TypeProgramVersionDescriptor
SMILES ACDLabs 12.01 O=C(NN)c1ccncc1
SMILES CACTVS 3.370 NNC(=O)c1ccncc1
SMILES OpenEye OEToolkits 1.7.0 c1cnccc1C(=O)NN
Canonical SMILES CACTVS 3.370 NNC(=O)c1ccncc1
Canonical SMILES OpenEye OEToolkits 1.7.0 c1cnccc1C(=O)NN

IUPAC InChI

InChI=1S/C6H7N3O/c7-9-6(10)5-1-3-8-4-2-5/h1-4H,7H2,(H,9,10)

IUPAC InChI key

QRXWMOHMRWLFEY-UHFFFAOYSA-N
NIZ

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

2010-05-21

Last modified at

2021-03-01

Status

Released

Obsoleted

Not Assigned