Chemical Components in the PDB

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U8O : Summary

Code

U8O

One-letter code

X

Molecule name

[1,2]thiazolo[5,4-b]pyridin-3-amine

Systematic names

ProgramVersionName
OpenEye OEToolkits 2.0.7 [1,2]thiazolo[5,4-b]pyridin-3-amine

Formula

C6 H5 N3 S

Formal charge

0

Molecular weight

151.189 Da

SMILES

TypeProgramVersionDescriptor
SMILES CACTVS 3.385 Nc1nsc2ncccc12
SMILES OpenEye OEToolkits 2.0.7 c1cc2c(nsc2nc1)N
Canonical SMILES CACTVS 3.385 Nc1nsc2ncccc12
Canonical SMILES OpenEye OEToolkits 2.0.7 c1cc2c(nsc2nc1)N

IUPAC InChI

InChI=1S/C6H5N3S/c7-5-4-2-1-3-8-6(4)10-9-5/h1-3H,(H2,7,9)

IUPAC InChI key

NVOYVQKFZVOHPB-UHFFFAOYSA-N
U8O

wwPDB Information

Atom count

15 (10 without Hydrogen)

Polymer type

Bound ligand

Type description

non-polymer

Type code

HETAIN

Is modified

No

Standard parent

Not Assigned

Defined at

2023-01-30

Last modified at

2024-02-02

Status

Released

Obsoleted

Not Assigned