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InChI=1S/CH4O/c1-2/h2H,1H3
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> Main
CHEBI:35812 - oxfendazole
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ChEBI Ontology
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ChEBI Name
oxfendazole
ChEBI ID
CHEBI:35812
Definition
A member of the class of benzimidazoles that is fenbendazole in which the sulfur has been oxidised to the corresponding sulfoxide.
Stars
This entity has been manually annotated by the ChEBI Team.
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Formula
C15H13N3O3S
Net Charge
0
Average Mass
315.34814
Monoisotopic Mass
315.06776
InChI
InChI=1S/C15H13N3O3S/c1-
21-
15(19)
18-
14-
16-
12-
8-
7-
11(9-
13(12)
17-
14)
22(20)
10-
5-
3-
2-
4-
6-
10/h2-
9H,1H3,(H2,16,17,18,19)
InChIKey
BEZZFPOZAYTVHN-UHFFFAOYSA-N
SMILES
COC(=O)Nc1nc2cc(ccc2[nH]1)S(=O)c1ccccc1
Roles Classification
Application
(s):
antinematodal drug
A substance used in the treatment or control of nematode infestations.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
oxfendazole (
CHEBI:35812
)
has functional parent
fenbendazole (
CHEBI:77092
)
oxfendazole (
CHEBI:35812
)
has role
antinematodal drug (
CHEBI:35444
)
oxfendazole (
CHEBI:35812
)
is a
benzimidazoles (
CHEBI:22715
)
oxfendazole (
CHEBI:35812
)
is a
carbamate ester (
CHEBI:23003
)
oxfendazole (
CHEBI:35812
)
is a
sulfoxide (
CHEBI:22063
)
IUPAC Name
methyl [5-(phenylsulfinyl)-1
H
-benzimidazol-2-yl]carbamate
Synonyms
Sources
(5-(phenylsulfinyl)-1
H
-benzimidazol-2-yl)carbamic acid methyl ester
ChemIDplus
5-(phenylsulfinyl)-2-benzimidazolecarbamic acid methyl ester
ChemIDplus
5-phenylsulfinyl-2-carbomethoxyaminobenzimidazole
ChemIDplus
fenbendazole
S
-oxide
UniProt
Fenbendazole sulfoxide
ChEBI
OFDZ
ChemIDplus
Manual Xrefs
Databases
1757
VSDB
LSM-1466
LINCS
Oxfendazole
Wikipedia
View more database links
Registry Numbers
Types
Sources
53716-50-0
CAS Registry Number
ChemIDplus
761290
Beilstein Registry Number
Beilstein
Last Modified
20 December 2017