AC1NN76F

4-(dimethylsulfamoyl)-N-[[5-[2-oxo-2-(1,3-thiazol-2-ylamino)ethyl]sulfanyl-4-phenyl-1,2,4-triazol-3-yl]methyl]benzamide

Also Known As: Oprea1_863801|F0721-0719|4-(dimethylsulfamoyl)-N-{[4-phenyl-5-({[(1,3-thiazol-2-yl)carbamoyl]methyl}sulfanyl)-4H-1,2,4-triazol-3-yl]methyl}benzamide|4-(N,N-dimethylsulfamoyl)-N-((5-((2-oxo-2-(thiazol-2-ylamino)ethyl)thio)-4-phenyl-4H-1,2,4-triazol-3-yl)methyl)benzamide|4-(dimethylsulfamoyl)-N-[[5-[2-oxo-2-(1,3-thiazol-2-ylamino)ethyl]sulfanyl-4-phenyl-1,2,4-triazol-3-yl]methyl]benzamide

Molecular Formula	C23H23N7O4S3
Molecular Weight	557.09735 g/mol
LogP	2.6349
Topological Polar Surface Area	139.18 Ų
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	9
Rotatable Bonds	10
Exact Mass	557.09735
Monoisotopic Mass	557.09735
Heavy Atoms	37
Complexity	1470.542

Chemical Identifiers

CAS Number	393875-21-3
SMILES	CN(C)S(=O)(=O)C1=CC=C(C=C1)C(=O)NCC2=NN=C(N2C3=CC=CC=C3)SCC(=O)NC4=NC=CS4