Methyl-N,N-diethylthiocarbamate (CHEBI:88842)

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ChEBI Name	Methyl-N,N-diethylthiocarbamate

ChEBI ID	CHEBI:88842

Stars	This entity has been manually annotated by a third party.

Supplier Information

Download	Molfile XML SDF

Formula

C6H13NOS2

Net Charge

Average Mass

179.306

Monoisotopic Mass

179.04386

InChI

InChI=1S/C6H13NOS2/c1-4-7(5-2)6(9)10(3)8/h4-5H2,1-3H3

InChIKey

VQRMNXBTDRJEKI-UHFFFAOYSA-N

SMILES

CCN(CC)C(=S)S(C)=O

Metabolite of Species	Details
Homo sapiens (NCBI:txid9606)	Found in saliva (UBERON:0001836). See: PubMed

ChEBI Ontology
Outgoing	Methyl-N,N-diethylthiocarbamate (CHEBI:88842) is a organic molecule (CHEBI:72695)

Synonyms	Sources
Methyl-N,N-diethylthiocarbamic acid	HMDB
N,N-diethyl-1-methanesulfinylmethanethioamide	HMDB