N-(sulfanylidenemethylidene)thiohydroxylamine

CHNS2 — CID 22214948

IUPACN-(sulfanylidenemethylidene)thiohydroxylamine
SMILESS=C=NS
InChIInChI=1S/CHNS2/c3-1-2-4/h4H
InChIKeyJUTXUCROFBCUPE-UHFFFAOYSA-N
MW91.16 g/mol
LogP0.93
Rot. Bonds

About N-(sulfanylidenemethylidene)thiohydroxylamine

N-(sulfanylidenemethylidene)thiohydroxylamine (PubChem CID 22214948) has the molecular formula CHNS2 and a molecular weight of 91.16 g/mol. Its IUPAC name is N-(sulfanylidenemethylidene)thiohydroxylamine.

Molecular Properties

Compound NameN-(sulfanylidenemethylidene)thiohydroxylamine
PubChem CID22214948
Molecular FormulaCHNS2
Molecular Weight91.16 g/mol
Exact Mass90.96
IUPAC NameN-(sulfanylidenemethylidene)thiohydroxylamine
SMILESS=C=NS
InChIInChI=1S/CHNS2/c3-1-2-4/h4H
InChIKeyJUTXUCROFBCUPE-UHFFFAOYSA-N
XLogP0.93
TPSA12.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms4
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50091.16
LogP ≤ 50.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Thiocarbonyl_group', 'substructure': 'N/A'}, {'alert_name': 'thiol_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-(sulfanylidenemethylidene)thiohydroxylamine?
The IUPAC name of N-(sulfanylidenemethylidene)thiohydroxylamine (CID 22214948) is N-(sulfanylidenemethylidene)thiohydroxylamine.
What is the SMILES notation for N-(sulfanylidenemethylidene)thiohydroxylamine?
The canonical SMILES for N-(sulfanylidenemethylidene)thiohydroxylamine is S=C=NS.
What is the InChIKey of N-(sulfanylidenemethylidene)thiohydroxylamine?
The InChIKey is JUTXUCROFBCUPE-UHFFFAOYSA-N. The full InChI is InChI=1S/CHNS2/c3-1-2-4/h4H.
What are the key properties of N-(sulfanylidenemethylidene)thiohydroxylamine?
N-(sulfanylidenemethylidene)thiohydroxylamine has a molecular weight of 91.16 g/mol, XLogP of 0.93, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(sulfanylidenemethylidene)thiohydroxylamine is sourced from PubChem (CID 22214948), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).