5-imino-4-methyl-1,3-thiazolidine-2-thione

C4H6N2S2 — CID 55286715

IUPAC5-imino-4-methyl-1,3-thiazolidine-2-thione
SMILES[H]/N=C1\SC(=S)NC1C
InChIInChI=1S/C4H6N2S2/c1-2-3(5)8-4(7)6-2/h2,5H,1H3,(H,6,7)/b5-3-
InChIKeyYZCGFCIQLUHSSQ-HYXAFXHYSA-N
MW146.24 g/mol
LogP0.97
Rot. Bonds

About 5-imino-4-methyl-1,3-thiazolidine-2-thione

5-imino-4-methyl-1,3-thiazolidine-2-thione (PubChem CID 55286715) has the molecular formula C4H6N2S2 and a molecular weight of 146.24 g/mol. Its IUPAC name is 5-imino-4-methyl-1,3-thiazolidine-2-thione.

Molecular Properties

Compound Name5-imino-4-methyl-1,3-thiazolidine-2-thione
PubChem CID55286715
Molecular FormulaC4H6N2S2
Molecular Weight146.24 g/mol
Exact Mass146.00
IUPAC Name5-imino-4-methyl-1,3-thiazolidine-2-thione
SMILES[H]/N=C1\SC(=S)NC1C
InChIInChI=1S/C4H6N2S2/c1-2-3(5)8-4(7)6-2/h2,5H,1H3,(H,6,7)/b5-3-
InChIKeyYZCGFCIQLUHSSQ-HYXAFXHYSA-N
XLogP0.97
TPSA35.88 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.24
LogP ≤ 50.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Thiocarbonyl_group', 'substructure': 'N/A'}

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Related Compounds

5-imino-4-methyl-1,3-thiazolidin-2-one
CID 55287325
4-methyl-1,3,6-thiadiazepane-2,7-dithione
CID 71356857
5-imino-4-propyl-1,3-thiazolidin-2-one
CID 121227390
5-methyl-1,3-thiazolidine-2,4-dithione
CID 71323977
5-methyl-1,3,4-thiadiazolidine-2-thione
CID 57451776
5-(4-chlorophenyl)-6-imino-3-methyl-1,3,4-thiadiazinane-2-thione
CID 91219786
5-methylpyrrolidine-2,4-dithione
CID 137473196
3-methyl-3,4-dihydro-1H-quinoxaline-2-thione
CID 21478536
5-tert-butylthiolan-2-imine
CID 19799650
6-imino-3,4-dimethoxycyclohexa-2,4-diene-1-thione
CID 101233754
4-(2-methylsulfanylethyl)-2-sulfanylidene-1,3-thiazolidin-5-one
CID 130006716
(4S)-4-(2-methylsulfanylethyl)-2-sulfanylidene-1,3-thiazolidin-5-one
CID 129415860

Frequently Asked Questions

What is the IUPAC name of 5-imino-4-methyl-1,3-thiazolidine-2-thione?
The IUPAC name of 5-imino-4-methyl-1,3-thiazolidine-2-thione (CID 55286715) is 5-imino-4-methyl-1,3-thiazolidine-2-thione.
What is the SMILES notation for 5-imino-4-methyl-1,3-thiazolidine-2-thione?
The canonical SMILES for 5-imino-4-methyl-1,3-thiazolidine-2-thione is [H]/N=C1\SC(=S)NC1C.
What is the InChIKey of 5-imino-4-methyl-1,3-thiazolidine-2-thione?
The InChIKey is YZCGFCIQLUHSSQ-HYXAFXHYSA-N. The full InChI is InChI=1S/C4H6N2S2/c1-2-3(5)8-4(7)6-2/h2,5H,1H3,(H,6,7)/b5-3-.
What are the key properties of 5-imino-4-methyl-1,3-thiazolidine-2-thione?
5-imino-4-methyl-1,3-thiazolidine-2-thione has a molecular weight of 146.24 g/mol, XLogP of 0.97, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-imino-4-methyl-1,3-thiazolidine-2-thione is sourced from PubChem (CID 55286715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).