AC1LQ64B

methyl 4-[[2-[[4-ethyl-5-[[(4-methylbenzoyl)amino]methyl]-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]benzoate

Also Known As: methyl 4-[({[4-ethyl-5-({[(4-methylphenyl)carbonyl]amino}methyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzoate|methyl 4-(2-((4-ethyl-5-((4-methylbenzamido)methyl)-4H-1,2,4-triazol-3-yl)thio)acetamido)benzoate|methyl 4-[[2-[[4-ethyl-5-[[(4-methylbenzoyl)amino]methyl]-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]benzoate

Molecular Formula	C23H25N5O4S
Molecular Weight	467.16272 g/mol
LogP	3.05382
Topological Polar Surface Area	115.21 Ų
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	7
Rotatable Bonds	9
Exact Mass	467.16272
Monoisotopic Mass	467.16272
Heavy Atoms	33
Complexity	1126.7584

Chemical Identifiers

CAS Number	713095-90-0
SMILES	CCN1C(=NN=C1SCC(=O)NC2=CC=C(C=C2)C(=O)OC)CNC(=O)C3=CC=C(C=C3)C