 Home > Encyclopedia > 4-[[5-(2-chlorophenyl)-4-ethyl-1,2,4-triazol-3-yl]sulfanylmethyl]benzonitrile

4-[[5-(2-chlorophenyl)-4-ethyl-1,2,4-triazol-3-yl]sulfanylmethyl]benzonitrile

4-[[5-(2-chlorophenyl)-4-ethyl-1,2,4-triazol-3-yl]sulfanylmethyl]benzonitrile structure

CAS No:
5302-36-3
Formula:
C18H15ClN4S
Chemical Name:
4-[[5-(2-chlorophenyl)-4-ethyl-1,2,4-triazol-3-yl]sulfanylmethyl]benzonitrile
Synonyms:
5302-36-3;4-[[5-(2-chlorophenyl)-4-ethyl-1,2,4-triazol-3-yl]sulfanylmethyl]benzonitrile;DTXSID20365901;ZINC2454003;STL299225;AKOS022109466;MCULE-9674737941;4-({[5-(2-chlorophenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)benzonitrile;ST50424836;4-(((5-(2-Chlorophenyl)-4-ethyl-4H-1,2,4-triazol-3-yl)thio)methyl)benzonitrile;4-{[5-(2-chlorophenyl)-4-ethyl-1,2,4-triazol-3-ylthio]methyl}benzenecarbonitri le;849029-36-3

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4-[[5-(2-chlorophenyl)-4-ethyl-1,2,4-triazol-3-yl]sulfanylmethyl]benzonitrile Basic Attributes

Molecular Weight：

354.9 g/mol

Exact Mass：

354.0705954 g/mol

DSSTox ID：

DTXSID20365901

Characteristics

PSA：

79.8 Å²

Computed Properties

Molecular Weight:354.9
XLogP3:4.1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:5
Exact Mass:354.0705954
Monoisotopic Mass:354.0705954
Topological Polar Surface Area:79.8
Heavy Atom Count:24
Complexity:446
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4-[[5-(2-chlorophenyl)-4-ethyl-1,2,4-triazol-3-yl]sulfanylmethyl]benzonitrile

Basic Attributes
Characteristics
Computed Properties

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