Loading
PDBj
MenuPDBj@FacebookPDBj@X(formerly Twitter)PDBj@BlueSkyPDBj@YouTubewwPDB FoundationwwPDB
RCSB PDBPDBeBMRBAdv. SearchSearch help

JAE

Summary
Name:1,3-benzothiazol-6-amine
Formula:C7 H6 N2 S
Formal charge:0
Formula weight:150.201 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.71,3-benzothiazol-6-amine

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.03InChI=1S/C7H6N2S/c8-5-1-2-6-7(3-5)10-4-9-6/h1-4H,8H2
InChIKeyInChI1.03FAYAYUOZWYJNBD-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385Nc1ccc2ncsc2c1
SMILESCACTVS3.385Nc1ccc2ncsc2c1
SMILES_CANONICALOpenEye OEToolkits2.0.7c1cc2c(cc1N)scn2
SMILESOpenEye OEToolkits2.0.7c1cc2c(cc1N)scn2

227344

PDB entries from 2024-11-13

PDB statisticsPDBj update infoContact PDBjnumon