CHEBI:36946 - thiourea

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name thiourea
ChEBI ID CHEBI:36946
Definition The simplest member of the thiourea class, consisting of urea with the oxygen atom substituted by sulfur.
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:35015, CHEBI:46065, CHEBI:29331
Supplier Information
Download Molfile XML SDF
more structures >>
Wikipedia License
Waiting for wikipedia content
Read full article at Wikipedia
Formula CH4N2S
Net Charge 0
Average Mass 76.12194
Monoisotopic Mass 76.010
InChI InChI=1S/CH4N2S/c2-1(3)4/h(H4,2,3,4)
InChIKey UMGDCJDMYOKAJW-UHFFFAOYSA-N
SMILES NC(N)=S
Roles Classification
Chemical Role(s): chromophore
The part (atom or group of atoms) of a molecular entity in which the electronic transition responsible for a given spectral band is approximately localized.
antioxidant
A substance that opposes oxidation or inhibits reactions brought about by dioxygen or peroxides.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing thiourea (CHEBI:36946) has functional parent carbonothioic O,O-acid (CHEBI:36958)
thiourea (CHEBI:36946) has functional parent urea (CHEBI:16199)
thiourea (CHEBI:36946) has role antioxidant (CHEBI:22586)
thiourea (CHEBI:36946) has role chromophore (CHEBI:23240)
thiourea (CHEBI:36946) is a one-carbon compound (CHEBI:64708)
thiourea (CHEBI:36946) is a thioureas (CHEBI:51276)
thiourea (CHEBI:36946) is a ureas (CHEBI:47857)
Incoming (4-bromophenyl)thiourea (CHEBI:34391) has functional parent thiourea (CHEBI:36946)
N-phenylthiourea (CHEBI:46261) has functional parent thiourea (CHEBI:36946)
allylthiourea (CHEBI:74079) has functional parent thiourea (CHEBI:36946)
carbamothioyl group (CHEBI:48225) is substituent group from thiourea (CHEBI:36946)
IUPAC Name
thiourea
Synonyms Sources
2-thiourea ChemIDplus
aminothioamide ChEBI
aminothiocarboxamide ChEBI
carbonothioic diamide IUPAC
H2NC(S)NH2 ChEBI
Thiocarbamid ChEBI
thiocarbamide NIST Chemistry WebBook
thiocarbonic acid diamide ChemIDplus
Thioharnstoff ChEBI
Thiokarbamid ChEBI
THIOUREA PDBeChem
Thiourea KEGG COMPOUND
tu IUPAC
Manual Xrefs Databases
641 PPDB
C14415 KEGG COMPOUND
Thiourea Wikipedia
TOU PDBeChem
US2173067 Patent
US2357149 Patent
US2393917 Patent
US2552584 Patent
US2560596 Patent
View more database links
Registry Numbers Types Sources
1604 Gmelin Registry Number Gmelin
605327 Beilstein Registry Number Beilstein
605327 Reaxys Registry Number Reaxys
62-56-6 CAS Registry Number NIST Chemistry WebBook
62-56-6 CAS Registry Number ChemIDplus
Citation Waiting for Citations Type Source
12102173 PubMed citation Europe PMC
Last Modified
12 December 2013