5-methyl-1,3-thiazolidine-2,4-dithione

C4H5NS3 — CID 71323977

IUPAC5-methyl-1,3-thiazolidine-2,4-dithione
SMILESCC1SC(=S)NC1=S
InChIInChI=1S/C4H5NS3/c1-2-3(6)5-4(7)8-2/h2H,1H3,(H,5,6,7)
InChIKeyRKLLXHCROVICJL-UHFFFAOYSA-N
MW163.29 g/mol
LogP1.32
Rot. Bonds

About 5-methyl-1,3-thiazolidine-2,4-dithione

5-methyl-1,3-thiazolidine-2,4-dithione (PubChem CID 71323977) has the molecular formula C4H5NS3 and a molecular weight of 163.29 g/mol. Its IUPAC name is 5-methyl-1,3-thiazolidine-2,4-dithione.

Molecular Properties

Compound Name5-methyl-1,3-thiazolidine-2,4-dithione
PubChem CID71323977
Molecular FormulaC4H5NS3
Molecular Weight163.29 g/mol
Exact Mass162.96
IUPAC Name5-methyl-1,3-thiazolidine-2,4-dithione
SMILESCC1SC(=S)NC1=S
InChIInChI=1S/C4H5NS3/c1-2-3(6)5-4(7)8-2/h2H,1H3,(H,5,6,7)
InChIKeyRKLLXHCROVICJL-UHFFFAOYSA-N
XLogP1.32
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.29
LogP ≤ 51.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Thiocarbonyl_group', 'substructure': 'N/A'}

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Related Compounds

2-methyl-4H-1,4-benzothiazine-3-thione
CID 84614586
5-methyl-1,3,4-thiadiazolidine-2-thione
CID 57451776
(5S)-5-[1-[(5S)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-yl]ethyl]-2-sulfanylidene-1,3-thiazolidin-4-one
CID 40559857
N-[4-(5-methylfuran-2-yl)phenyl]hydroxylamine;5-methyl-2-sulfanylidene-1,3-thiazolidin-4-one
CID 142878486
5-methyl-2-sulfanylthiadiazolidine-4-thione
CID 89252133
(2S)-2-methylthiomorpholine-3-thione
CID 139962054
5-methyl-4-sulfanylidene-1,3-thiazinan-2-one
CID 130009696
5-imino-4-methyl-1,3-thiazolidine-2-thione
CID 55286715
3-methyl-3,4-dihydro-1H-quinoxaline-2-thione
CID 21478536
2,6,7-trimethyl-4H-1,4-benzoxazine-3-thione
CID 21256529
2-[(5S)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-yl]acetic acid
CID 51385264
(5S)-3-(2-chlorophenyl)-5-methyl-2-sulfanylidene-1,3-thiazolidin-4-one
CID 101352972

Frequently Asked Questions

What is the IUPAC name of 5-methyl-1,3-thiazolidine-2,4-dithione?
The IUPAC name of 5-methyl-1,3-thiazolidine-2,4-dithione (CID 71323977) is 5-methyl-1,3-thiazolidine-2,4-dithione.
What is the SMILES notation for 5-methyl-1,3-thiazolidine-2,4-dithione?
The canonical SMILES for 5-methyl-1,3-thiazolidine-2,4-dithione is CC1SC(=S)NC1=S.
What is the InChIKey of 5-methyl-1,3-thiazolidine-2,4-dithione?
The InChIKey is RKLLXHCROVICJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H5NS3/c1-2-3(6)5-4(7)8-2/h2H,1H3,(H,5,6,7).
What are the key properties of 5-methyl-1,3-thiazolidine-2,4-dithione?
5-methyl-1,3-thiazolidine-2,4-dithione has a molecular weight of 163.29 g/mol, XLogP of 1.32, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-1,3-thiazolidine-2,4-dithione is sourced from PubChem (CID 71323977), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).