5-[[(3-Chlorophenyl)amino]carbonyl]-1,3,4-thiadiazole-2-butanoic acid

CAS Registry Number®

1142209-51-5

CAS Name

5-[[(3-Chlorophenyl)amino]carbonyl]-1,3,4-thiadiazole-2-butanoic acid

Molecular Formula

C13H12ClN3O3S

Molecular Mass

325.77

Cite this Page

5-[[(3-Chlorophenyl)amino]carbonyl]-1,3,4-thiadiazole-2-butanoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1142209-51-5 (retrieved 2024-12-02) (CAS RN: 1142209-51-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C13H12ClN3O3S/c14-8-3-1-4-9(7-8)15-12(20)13-17-16-10(21-13)5-2-6-11(18)19/h1,3-4,7H,2,5-6H2,(H,15,20)(H,18,19)

InChIKey

InChIKey=SYRJWSLECOXZJB-UHFFFAOYSA-N

SMILES

C(NC1=CC(Cl)=CC=C1)(=O)C=2SC(CCCC(O)=O)=NN2

Canonical SMILES

O=C(O)CCCC1=NN=C(S1)C(=O)NC=2C=CC=C(Cl)C2

Other Names for this Substance

  • 1,3,4-Thiadiazole-2-butanoic acid, 5-[[(3-chlorophenyl)amino]carbonyl]-
  • 5-[[(3-Chlorophenyl)amino]carbonyl]-1,3,4-thiadiazole-2-butanoic acid

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