ethylthiourea;thiophene

C7H12N2S2 — CID 23294578

IUPACethylthiourea;thiophene
SMILESCCNC(N)=S.c1ccsc1
InChIInChI=1S/C4H4S.C3H8N2S/c1-2-4-5-3-1;1-2-5-3(4)6/h1-4H;2H2,1H3,(H3,4,5,6)
InChIKeyIKSDOGDJZGKXBF-UHFFFAOYSA-N
MW188.32 g/mol
LogP1.59
Rot. Bonds1

About ethylthiourea;thiophene

ethylthiourea;thiophene (PubChem CID 23294578) has the molecular formula C7H12N2S2 and a molecular weight of 188.32 g/mol. Its IUPAC name is ethylthiourea;thiophene.

Molecular Properties

Compound Nameethylthiourea;thiophene
PubChem CID23294578
Molecular FormulaC7H12N2S2
Molecular Weight188.32 g/mol
Exact Mass188.04
IUPAC Nameethylthiourea;thiophene
SMILESCCNC(N)=S.c1ccsc1
InChIInChI=1S/C4H4S.C3H8N2S/c1-2-4-5-3-1;1-2-5-3(4)6/h1-4H;2H2,1H3,(H3,4,5,6)
InChIKeyIKSDOGDJZGKXBF-UHFFFAOYSA-N
XLogP1.59
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.32
LogP ≤ 51.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze ethylthiourea;thiophene with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of ethylthiourea;thiophene?
The IUPAC name of ethylthiourea;thiophene (CID 23294578) is ethylthiourea;thiophene.
What is the SMILES notation for ethylthiourea;thiophene?
The canonical SMILES for ethylthiourea;thiophene is CCNC(N)=S.c1ccsc1.
What is the InChIKey of ethylthiourea;thiophene?
The InChIKey is IKSDOGDJZGKXBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H4S.C3H8N2S/c1-2-4-5-3-1;1-2-5-3(4)6/h1-4H;2H2,1H3,(H3,4,5,6).
What are the key properties of ethylthiourea;thiophene?
ethylthiourea;thiophene has a molecular weight of 188.32 g/mol, XLogP of 1.59, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethylthiourea;thiophene is sourced from PubChem (CID 23294578), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).