AC1LKNO3

N-(2,3-dimethylphenyl)-2-[[5-[(4-methylanilino)methyl]-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]acetamide

Also Known As: BAS 01556311|N-(2,3-Dimethylphenyl)-2-((4-phenyl-5-((p-tolylamino)methyl)-4H-1,2,4-triazol-3-yl)thio)acetamide|AG-690/40749894|N-(2,3-dimethylphenyl)-2-[[5-[(4-methylanilino)methyl]-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]acetamide|N-(2,3-Dimethyl-phenyl)-2-[4-phenyl-5-(p-tolylamino-methyl)-4H-[1,2,4]triazol-3-ylsulfanyl]-acetamide|N-(2,3-dimethylphenyl)-2-(5-{[(4-methylphenyl)amino]methyl}-4-phenyl(1,2,4-tri azol-3-ylthio))acetamide|N-(2,3-dimethylphenyl)-2-{[4-phenyl-5-(4-toluidinomethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide

Molecular Formula	C26H27N5OS
Molecular Weight	457.19363 g/mol
LogP	5.53546
Topological Polar Surface Area	71.84 Ų
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	5
Rotatable Bonds	8
Exact Mass	457.19363
Monoisotopic Mass	457.19363
Heavy Atoms	33
Complexity	1235.5393

Chemical Identifiers

CAS Number	332907-06-9
SMILES	CC1=CC=C(C=C1)NCC2=NN=C(N2C3=CC=CC=C3)SCC(=O)NC4=CC=CC(=C4C)C