4-[5-[[2-(Cyclohexylamino)-2-oxoethyl]thio]-1,3,4-oxadiazol-2-yl]benzoic acid

CAS Registry Number®

881445-79-0
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CAS Name

4-[5-[[2-(Cyclohexylamino)-2-oxoethyl]thio]-1,3,4-oxadiazol-2-yl]benzoic acid

Molecular Formula

C17H19N3O4S

Molecular Mass

361.42

Cite this Page

4-[5-[[2-(Cyclohexylamino)-2-oxoethyl]thio]-1,3,4-oxadiazol-2-yl]benzoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=881445-79-0 (retrieved 2024-09-07) (CAS RN: 881445-79-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C17H19N3O4S/c21-14(18-13-4-2-1-3-5-13)10-25-17-20-19-15(24-17)11-6-8-12(9-7-11)16(22)23/h6-9,13H,1-5,10H2,(H,18,21)(H,22,23)

InChIKey

InChIKey=QPBHGHSDPMXBRK-UHFFFAOYSA-N

SMILES

S(CC(NC1CCCCC1)=O)C=2OC(=NN2)C3=CC=C(C(O)=O)C=C3

Canonical SMILES

O=C(O)C=1C=CC(=CC1)C2=NN=C(O2)SCC(=O)NC3CCCCC3

Other Names for this Substance

  • Benzoic acid, 4-[5-[[2-(cyclohexylamino)-2-oxoethyl]thio]-1,3,4-oxadiazol-2-yl]-
  • 4-[5-[[2-(Cyclohexylamino)-2-oxoethyl]thio]-1,3,4-oxadiazol-2-yl]benzoic acid