Almokalant
CAS Registry Number®
123955-10-2
No image available.
CAS Name
AlmokalantMolecular Formula
C18H28N2O3SMolecular Mass
352.49Cite this Page
Almokalant. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=123955-10-2 (retrieved ) (CAS RN: 123955-10-2). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C18H28N2O3S/c1-3-11-24(22)12-5-10-20(4-2)14-17(21)15-23-18-8-6-16(13-19)7-9-18/h6-9,17,21H,3-5,10-12,14-15H2,1-2H3
InChIKey
InChIKey=ZMHOBBKJBYLXFR-UHFFFAOYSA-N
SMILES
O(CC(CN(CCCS(CCC)=O)CC)O)C1=CC=C(C#N)C=C1
Canonical SMILES
N#CC1=CC=C(OCC(O)CN(CC)CCCS(=O)CCC)C=C1
Other Names for this Substance
- Benzonitrile, 4-[3-[ethyl[3-(propylsulfinyl)propyl]amino]-2-hydroxypropoxy]-
- 4-[3-[Ethyl[3-(propylsulfinyl)propyl]amino]-2-hydroxypropoxy]benzonitrile
- Almokalant
- H 234/09
