AC1LOXAW

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

Also Known As: 4-({[4-(4-methylphenyl)-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)benzonitrile|4-(((5-(pyridin-4-yl)-4-(p-tolyl)-4H-1,2,4-triazol-3-yl)thio)methyl)benzonitrile|4-[[4-(4-methylphenyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanylmethyl]benzonitrile|4-{[4-(4-methylphenyl)-5-(4-pyridyl)-1,2,4-triazol-3-ylthio]methyl}benzenecarb onitrile|4-({[4-(4-methylphenyl)-5-(4-pyridinyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)benzonitrile

Molecular Formula	C22H17N5S
Molecular Weight	383.12045 g/mol
LogP	4.8017
Topological Polar Surface Area	67.39 Ų
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	5
Rotatable Bonds	5
Exact Mass	383.12045
Monoisotopic Mass	383.12045
Heavy Atoms	28
Complexity	1110.5634

Chemical Identifiers

CAS Number	499124-74-2
SMILES	CC1=CC=C(C=C1)N2C(=NN=C2SCC3=CC=C(C=C3)C#N)C4=CC=NC=C4