AC1MHW1X

N-[2-[(2,5-dimethylphenyl)carbamothioylamino]cyclopentyl]-N-methyl-4-nitrobenzamide

Also Known As: Benzamide, N-(2-((((2,5-dimethylphenyl)amino)thioxomethyl)amino)cyclopentyl)-N-methyl-4-nitro-|N-(2-((((2,5-Dimethylphenyl)amino)thioxomethyl)amino)cyclopentyl)-N-methyl-4-nitrobenzamide|N-(2,5-Dimethylphenyl)-N'-[2-(N-methyl-4-nitrobenzamido)cyclopentyl]carbamimidothioic acid|N-[2-[(2,5-dimethylphenyl)carbamothioylamino]cyclopentyl]-N-methyl-4-nitrobenzamide|N-(2,5-Dimethylphenyl)-N'-{2-[methyl(4-nitrobenzoyl)amino]cyclopentyl}carbamimidothioic acid

Molecular Formula	C22H26N4O3S
Molecular Weight	426.17258 g/mol
LogP	4.19134
Topological Polar Surface Area	87.51 Ų
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	4
Rotatable Bonds	5
Exact Mass	426.17258
Monoisotopic Mass	426.17258
Heavy Atoms	30
Complexity	961.35504

Chemical Identifiers

CAS Number	77051-89-9
SMILES	CC1=CC(=C(C=C1)C)NC(=S)NC2CCCC2N(C)C(=O)C3=CC=C(C=C3)[N+](=O)[O-]