AC1N4NYH

4-(diethylsulfamoyl)-N-[5-[2-oxo-2-(1,3-thiazol-2-ylamino)ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]benzamide

Also Known As: Oprea1_170352|F0417-1452|4-(diethylsulfamoyl)-N-[5-({[(1,3-thiazol-2-yl)carbamoyl]methyl}sulfanyl)-1,3,4-thiadiazol-2-yl]benzamide|4-(diethylsulfamoyl)-N-[5-[2-oxo-2-(1,3-thiazol-2-ylamino)ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]benzamide|4-(N,N-diethylsulfamoyl)-N-(5-((2-oxo-2-(thiazol-2-ylamino)ethyl)thio)-1,3,4-thiadiazol-2-yl)benzamide|(diethylamino)-p-{N-5-[(N-1,3-thiazol-2-ylcarbamoyl)methylthio]-1,3,4-thiadiazol-2-ylcarbamoyl}phenyl(oxo)-lambda-sulfaniumolate

Molecular Formula	C18H20N6O4S4
Molecular Weight	512.0429 g/mol
LogP	3.0082
Topological Polar Surface Area	134.25 Ų
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	10
Rotatable Bonds	10
Exact Mass	512.0429
Monoisotopic Mass	512.0429
Heavy Atoms	32
Complexity	1158.5636

Chemical Identifiers

CAS Number	392299-85-3
SMILES	CCN(CC)S(=O)(=O)C1=CC=C(C=C1)C(=O)NC2=NN=C(S2)SCC(=O)NC3=NC=CS3