Chemical Component Summary

Name3-(6-chloro-1,3-benzothiazol-2-yl)-L-alanine
Identifiers(2~{S})-2-azanyl-3-(6-chloranyl-1,3-benzothiazol-2-yl)propanoic acid
FormulaC10 H9 Cl N2 O2 S
Molecular Weight256.709
TypePEPTIDE LINKING
Isomeric SMILESc1cc2c(cc1Cl)sc(n2)C[C@@H](C(=O)O)N
InChIInChI=1S/C10H9ClN2O2S/c11-5-1-2-7-8(3-5)16-9(13-7)4-6(12)10(14)15/h1-3,6H,4,12H2,(H,14,15)/t6-/m0/s1
InChIKeyKSSCXTPJNWLKBQ-LURJTMIESA-N

Chemical Details

Formal Charge0
Atom Count25
Chiral Atom Count1
Bond Count26
Aromatic Bond Count10

Related Resource References

Resource NameReference
PubChem 137349144