2-[(4-cyano-1-methyl-5,6,7,8-tetrahydroisoquinolin-3-yl)sulfanyl]-N-(3-ethoxyphenyl)acetamide
-
![2-[(4-cyano-1-methyl-5,6,7,8-tetrahydroisoquinolin-3-yl)sulfanyl]-N-(3-ethoxyphenyl)acetamide structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/a4f89c83957d44c18f002b1bee54983a.png "2-[(4-cyano-1-methyl-5,6,7,8-tetrahydroisoquinolin-3-yl)sulfanyl]-N-(3-ethoxyphenyl)acetamide")
2-[(4-cyano-1-methyl-5,6,7,8-tetrahydroisoquinolin-3-yl)sulfanyl]-N-(3-ethoxyphenyl)acetamide
structure -
-
CAS No:
607696-72-0
-
Formula:
C21H23N3O2S
-
Chemical Name:
2-[(4-cyano-1-methyl-5,6,7,8-tetrahydroisoquinolin-3-yl)sulfanyl]-N-(3-ethoxyphenyl)acetamide
-
Synonyms:
2-[(4-cyano-1-methyl-5,6,7,8-tetrahydroisoquinolin-3-yl)sulfanyl]-N-(3-ethoxyphenyl)acetamide;2-[(4-cyano-1-methyl-5,6,7,8-tetrahydroisoquinolin-3-yl)thio]-N-(3-ethoxyphenyl)acetamide;SMR000148050;MLS000556933;CHEMBL1604887;CHEBI:105238;HMS2390A05;ZINC1471611;STK166547;AKOS002172190;MCULE-9850233883;ST50055765;Q27182947;2-(4-cyano-1-methyl(3-5,6,7,8-tetrahydroisoquinolylthio))-N-(3-ethoxyphenyl)ac etamide;2-(4-Cyano-1-methyl-5,6,7,8-tetrahydro-isoquinolin-3-ylsulfanyl)-N-(3-ethoxy-phenyl)-acetamide;607696-72-0
-
CAS No:
Description
2-[(4-cyano-1-methyl-5,6,7,8-tetrahydroisoquinolin-3-yl)thio]-N-(3-ethoxyphenyl)acetamide is an anilide.
2-[(4-cyano-1-methyl-5,6,7,8-tetrahydroisoquinolin-3-yl)sulfanyl]-N-(3-ethoxyphenyl)acetamide Basic Attributes
381.5 g/mol
381.15109816 g/mol
Computed Properties
Molecular Weight:381.5
XLogP3:4.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:6
Exact Mass:381.15109816
Monoisotopic Mass:381.15109816
Topological Polar Surface Area:100
Heavy Atom Count:27
Complexity:549
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
Request for Quotation