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Propanamide, 3-(2,2-dimethyl-1-((phenylamino)thioxomethyl)hydrazino)-2-methyl-

HCID 3024697
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Basic information

CAS
96804-75-0
Standard SMILES
CC(CN(C(=S)Nc1ccccc1)N(C)C)C(N)=O
InChIKey
IBNCJQWJXZCMPV-UHFFFAOYSA-N
Molecular formula
C13H20N4OS
Average molar mass
280.39 g/mol
Monoisotopic mass
280.13578245

Names & identifiers

Preferred name
Propanamide, 3-(2,2-dimethyl-1-((phenylamino)thioxomethyl)hydrazino)-2-methyl-
IUPAC
3-[dimethylamino(phenylcarbamothioyl)amino]-2-methylpropanamide
English name
3-(2,2-Dimethyl-1-phenylthiocarbamoylhydrazino)-2-methylpropionamide
Molecular formula
C13H20N4OS
Molecular weight
280.39

Names & synonyms

96804-75-03-(2,2-Dimethyl-1-phenylthiocarbamoylhydrazino)-2-methylpropionamide3-(2,2-Dimethyl-1-((phenylamino)thioxomethyl)hydrazino)-2-methylpropanamidePropanamide, 3-(2,2-dimethyl-1-((phenylamino)thioxomethyl)hydrazino)-2-methyl-RefChem:374064SCHEMBL10905453DTXSID009142993-{2,2-Dimethyl-1-[(phenylimino)(sulfanyl)methyl]hydrazin-1-yl}-2-methylpropanimidic acid3-{2,2-Dimethyl-1-[(phenylimino)(sulfanyl)methyl]hydrazinyl}-2-methylpropanimidic acidPropanamide, 3-[2,2-dimethyl-1-[(phenylamino)thioxomethyl]hydrazinyl]-2-methyl-

Database identifiers

CAS
96804-75-0
PubChem CID
3024697
DTXSID
DTXSID00914299

Properties

Computed structural propertiesFilling in

XLogP
1.4
Topological polar surface area
93.7 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
3
Rotatable bonds
5
Heavy atoms
19
Formal charge
0
Complexity
316

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