methyl 4-({[(5-methyl-4-phenyl-4H-1,2,4-triazol-3-yl)thio]acetyl}amino)benzoate

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

Also Known As: CBKinase1_002920|CBKinase1_015320|BAS 02071225|AG-690/40698269|BRD-K36051218-001-01-2|methyl 4-({[(5-methyl-4-phenyl-4H-1,2,4-triazol-3-yl)thio]acetyl}amino)benzoate|Methyl 4-[[2-[(5-methyl-4-phenyl-4H-1,2,4-triazol-3-yl)thio]acetyl]amino]benzoate|methyl 4-({[(5-methyl-4-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetyl}amino)benzoate|methyl 4-[[2-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]benzoate|methyl 4-(2-((5-methyl-4-phenyl-4H-1,2,4-triazol-3-yl)thio)acetamido)benzoate|Methyl 4-{2-[(5-methyl-4-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetamido}benzoate|METHYL 4-({2-[(5-METHYL-4-PHENYL-4H-1,2,4-TRIAZOL-3-YL)SULFANYL]ACETYL}AMINO)BENZOATE

Molecular Formula	C19H18N4O3S
Molecular Weight	382.10995 g/mol
LogP	3.09312
Topological Polar Surface Area	86.11 Ų
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	6
Rotatable Bonds	6
Exact Mass	382.10995
Monoisotopic Mass	382.10995
Heavy Atoms	27
Complexity	939.34845

Chemical Identifiers

CAS Number	332883-22-4
SMILES	CC1=NN=C(N1C2=CC=CC=C2)SCC(=O)NC3=CC=C(C=C3)C(=O)OC