AC1M10C4

ethyl 4-[[2-[[4-(4-methylphenyl)-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]benzoate

Also Known As: ethyl 4-(2-((5-(thiophen-2-ylmethyl)-4-(p-tolyl)-4H-1,2,4-triazol-3-yl)thio)acetamido)benzoate|ethyl 4-(2-{[4-(4-methylphenyl)-5-(thiophen-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamido)benzoate|ethyl 4-[({[4-(4-methylphenyl)-5-(thiophen-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzoate|ethyl 4-[[2-[[4-(4-methylphenyl)-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]benzoate|ethyl 4-{2-[4-(4-methylphenyl)-5-(2-thienylmethyl)-1,2,4-triazol-3-ylthio]acet ylamino}benzoate

Molecular Formula	C25H24N4O3S2
Molecular Weight	492.129 g/mol
LogP	5.13552
Topological Polar Surface Area	86.11 Ų
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	7
Rotatable Bonds	9
Exact Mass	492.129
Monoisotopic Mass	492.129
Heavy Atoms	34
Complexity	1250.575

Chemical Identifiers

CAS Number	896601-72-2
SMILES	CCOC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NN=C(N2C3=CC=C(C=C3)C)CC4=CC=CS4