AC1NFN9B

3-[(4-bromophenyl)methylsulfanyl]-5-[(4-methylphenoxy)methyl]-4-prop-2-enyl-1,2,4-triazole

Also Known As: 3-[(4-bromophenyl)methylsulfanyl]-5-[(4-methylphenoxy)methyl]-4-prop-2-enyl-1,2,4-triazole|4-allyl-3-((4-bromobenzyl)thio)-5-((p-tolyloxy)methyl)-4H-1,2,4-triazole|1-({5-[(4-bromophenyl)methylthio]-4-prop-2-enyl(1,2,4-triazol-3-yl)}methoxy)-4 -methylbenzene|3-[(4-bromobenzyl)sulfanyl]-5-[(4-methylphenoxy)methyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazole|3-{[(4-bromophenyl)methyl]sulfanyl}-5-(4-methylphenoxymethyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazole

Molecular Formula	C20H20BrN3OS
Molecular Weight	429.05106 g/mol
LogP	5.40632
Topological Polar Surface Area	39.94 Ų
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	4
Rotatable Bonds	8
Exact Mass	429.05106
Monoisotopic Mass	429.05106
Heavy Atoms	26
Complexity	792.76776

Chemical Identifiers

CAS Number	861122-43-2
SMILES	CC1=CC=C(C=C1)OCC2=NN=C(N2CC=C)SCC3=CC=C(C=C3)Br