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4-[[4-(4-methylphenyl)-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanylmethyl]benzonitrile

4-[[4-(4-methylphenyl)-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanylmethyl]benzonitrile structure

CAS No:
896843-07-5
Formula:
C22H18N4S2
Chemical Name:
4-[[4-(4-methylphenyl)-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanylmethyl]benzonitrile
Synonyms:
MLS003128021;ZINC2230094;STK597463;AKOS005518860;MCULE-3233648248;4-({[4-(4-methylphenyl)-5-(thiophen-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)benzonitrile;SMR001836083;ST50419476;4-{[4-(4-methylphenyl)-5-(2-thienylmethyl)-1,2,4-triazol-3-ylthio]methyl}benze necarbonitrile;896843-07-5

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4-[[4-(4-methylphenyl)-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanylmethyl]benzonitrile Basic Attributes

Molecular Weight：

402.5 g/mol

Exact Mass：

402.09728894 g/mol

Characteristics

PSA：

108 Å²

Computed Properties

Molecular Weight:402.5
XLogP3:5.2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:6
Exact Mass:402.09728894
Monoisotopic Mass:402.09728894
Topological Polar Surface Area:108
Heavy Atom Count:28
Complexity:534
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4-[[4-(4-methylphenyl)-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanylmethyl]benzonitrile

Basic Attributes
Characteristics
Computed Properties

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