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4(5H)-Thiazolone, 3-(dimethylamino)dihydro-2-thioxo-

HCID 4341978
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
CN(C)N1C(=O)CSC1=S
InChIKey
QKYRYMYVJBFZGG-UHFFFAOYSA-N
Molecular formula
C5H8N2OS2
Average molar mass
176.3 g/mol
Monoisotopic mass
176.00780523

Names & identifiers

Preferred name
4(5H)-Thiazolone, 3-(dimethylamino)dihydro-2-thioxo-
IUPAC
3-(dimethylamino)-2-sulfanylidene-1,3-thiazolidin-4-one

Names & synonyms

3-(dimethylamino)-2-sulfanylidene-1,3-thiazolidin-4-one4(5H)-Thiazolone, 3-(dimethylamino)dihydro-2-thioxo-N-dimethylaminorhodanineSCHEMBL79746103-(DIMETHYLAMINO)RHODANINEAKOS024336178[3-(dimethylamino)-2-thioxothiazolidine-4-one]

Database identifiers

PubChem CID
4341978
Nikkaji
J564.360K

Properties

Computed structural properties

XLogP
1.1
Topological polar surface area
80.9 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
1
Heavy atoms
10
Formal charge
0
Complexity
180

Related reactions

8 records
New reaction record
HRID 2948 reaction equation
HRID 2948As reactantuspto-grants-1998_03
HRID 273887 reaction equation
HRID 273887As reactantuspto-grants-1995_02
HRID 273891 reaction equation
HRID 273891As reactantuspto-grants-1995_02
HRID 467199 reaction equation
HRID 467199As reactantuspto-grants-1992_10
HRID 827292 reaction equation
HRID 827292As reactantTest data from https://doi.org/10.1039/C8SC04228D
HRID 1586733 reaction equation
HRID 1586733As reactantuspto-grants-1993_06
HRID 1708248 reaction equation
HRID 1708248As reactantuspto-grants-1994_10
HRID 2295072 reaction equation
HRID 2295072As reactantuspto-grants-1997_11

Compound notes

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