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 acidMolecular Formula
C17H19N3O4SMolecular Mass
361.42Cite 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 ) (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