hydrazinylsulfanylmethanethioic S-acid

CH4N2OS2 — CID 154119373

IUPAChydrazinylsulfanylmethanethioic S-acid
SMILESNNSC(=O)S
InChIInChI=1S/CH4N2OS2/c2-3-6-1(4)5/h3H,2H2,(H,4,5)
InChIKeySUQCLJCEFZPPPJ-UHFFFAOYSA-N
MW124.19 g/mol
LogP0.15
Rot. Bonds1

About hydrazinylsulfanylmethanethioic S-acid

hydrazinylsulfanylmethanethioic S-acid (PubChem CID 154119373) has the molecular formula CH4N2OS2 and a molecular weight of 124.19 g/mol. Its IUPAC name is hydrazinylsulfanylmethanethioic S-acid.

Molecular Properties

Compound Namehydrazinylsulfanylmethanethioic S-acid
PubChem CID154119373
Molecular FormulaCH4N2OS2
Molecular Weight124.19 g/mol
Exact Mass123.98
IUPAC Namehydrazinylsulfanylmethanethioic S-acid
SMILESNNSC(=O)S
InChIInChI=1S/CH4N2OS2/c2-3-6-1(4)5/h3H,2H2,(H,4,5)
InChIKeySUQCLJCEFZPPPJ-UHFFFAOYSA-N
XLogP0.15
TPSA55.12 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500124.19
LogP ≤ 50.15
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'sulphur_nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'thioester', 'substructure': 'N/A'}, {'alert_name': 'thiol_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of hydrazinylsulfanylmethanethioic S-acid?
The IUPAC name of hydrazinylsulfanylmethanethioic S-acid (CID 154119373) is hydrazinylsulfanylmethanethioic S-acid.
What is the SMILES notation for hydrazinylsulfanylmethanethioic S-acid?
The canonical SMILES for hydrazinylsulfanylmethanethioic S-acid is NNSC(=O)S.
What is the InChIKey of hydrazinylsulfanylmethanethioic S-acid?
The InChIKey is SUQCLJCEFZPPPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/CH4N2OS2/c2-3-6-1(4)5/h3H,2H2,(H,4,5).
What are the key properties of hydrazinylsulfanylmethanethioic S-acid?
hydrazinylsulfanylmethanethioic S-acid has a molecular weight of 124.19 g/mol, XLogP of 0.15, 1 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for hydrazinylsulfanylmethanethioic S-acid is sourced from PubChem (CID 154119373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).