Butyl 4-[({[2-chloro-5-(methylsulfanyl)benzoyl]amino}carbothioyl)amino]benzoate structure

Butyl 4-[({[2-chloro-5-(methylsulfanyl)benzoyl]amino}carbothioyl)amino]benzoate

butyl 4-[(2-chloro-5-methylsulfanylbenzoyl)carbamothioylamino]benzoate

Also Known As: AK-968/41025279|butyl 4-[({[2-chloro-5-(methylsulfanyl)benzoyl]amino}carbothioyl)amino]benzoate|butyl 4-[(2-chloro-5-methylsulfanylbenzoyl)carbamothioylamino]benzoate|butyl 4-(3-(2-chloro-5-(methylthio)benzoyl)thioureido)benzoate|butyl 4-[({[2-chloro-5-(methylsulfanyl)phenyl]carbonyl}carbamothioyl)amino]benzoate

CAS: 445240-49-3
Molecular Formula C20H21ClN2O3S2
Molecular Weight 436.0682 g/mol
LogP 5.1456
Topological Polar Surface Area 67.43 Ų
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 5
Rotatable Bonds 7
Exact Mass 436.0682
Monoisotopic Mass 436.0682
Heavy Atoms 28
Complexity 857.02936

Chemical Identifiers

CAS Number 445240-49-3
SMILES CCCCOC(=O)C1=CC=C(C=C1)NC(=S)NC(=O)C2=C(C=CC(=C2)SC)Cl

Product Overview

Butyl 4-[({[2-chloro-5-(methylsulfanyl)benzoyl]amino}carbothioyl)amino]benzoate (CAS 445240-49-3), with molecular formula C20H21ClN2O3S2 and molecular weight 436.0682 g/mol. IUPAC: butyl 4-[(2-chloro-5-methylsulfanylbenzoyl)carbamothioylamino]benzoate.

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Butyl 4-[({[2-chloro-5-(methylsulfanyl)benzoyl]amino}carbothioyl)amino]benzoate is a custom synthesis product. We offer services from milligram to kilogram scale.

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