AC1MHW1I

N-methyl-N-[2-[(4-methylphenyl)carbamothioylamino]cyclopentyl]-2-nitrobenzamide

Also Known As: N-Methyl-N-(2-((((4-methylphenyl)amino)thioxomethyl)amino)cyclopentyl)-2-nitrobenzamide|Benzamide, N-methyl-N-(2-((((4-methylphenyl)amino)thioxomethyl)amino)cyclopentyl)-2-nitro-|BENZAMIDE, N-METHYL-N-(2-((((4-METHYLPHENYL)AMINO)THIOXOMETHYL)AMINO)CYCLOPENTYL|N'-[2-(N-Methyl-2-nitrobenzamido)cyclopentyl]-N-(4-methylphenyl)carbamimidothioic acid|N'-{2-[Methyl(2-nitrobenzoyl)amino]cyclopentyl}-N-(4-methylphenyl)carbamimidothioic acid|N-methyl-N-[2-[(4-methylphenyl)carbamothioylamino]cyclopentyl]-2-nitrobenzamide

Molecular Formula	C21H24N4O3S
Molecular Weight	412.15692 g/mol
LogP	3.88292
Topological Polar Surface Area	87.51 Ų
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	4
Rotatable Bonds	5
Exact Mass	412.15692
Monoisotopic Mass	412.15692
Heavy Atoms	29
Complexity	916.39716

Chemical Identifiers

CAS Number	77051-82-2
SMILES	CC1=CC=C(C=C1)NC(=S)NC2CCCC2N(C)C(=O)C3=CC=CC=C3[N+](=O)[O-]