U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C7H14S
Molecular Weight 130.251
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Allyl butyl sulfide

SMILES

CCCCSCC=C

InChI

InChIKey=HXMYUSWENPCWFT-UHFFFAOYSA-N
InChI=1S/C7H14S/c1-3-5-7-8-6-4-2/h4H,2-3,5-7H2,1H3

HIDE SMILES / InChI

Approval Year

Name Type Language
Allyl butyl sulfide
Systematic Name English
1-(2-Propen-1-ylthio)butane
Systematic Name English
1-(Prop-2-en-1-ylsulfanyl)butane
Systematic Name English
1-[(2-Propenyl)thio]butane
Systematic Name English
Sulfide, allyl butyl
Systematic Name English
Butyl allyl sulfide
Systematic Name English
Butane, 1-(2-propenylthio)-
Systematic Name English
Butane, 1-(2-propen-1-ylthio)-
Systematic Name English
NSC-1111
Code English
Code System Code Type Description
PUBCHEM
219614
Created by admin on Sat Dec 16 19:16:58 GMT 2023 , Edited by admin on Sat Dec 16 19:16:58 GMT 2023
PRIMARY
NSC
1111
Created by admin on Sat Dec 16 19:16:58 GMT 2023 , Edited by admin on Sat Dec 16 19:16:58 GMT 2023
PRIMARY
CAS
5399-19-9
Created by admin on Sat Dec 16 19:16:58 GMT 2023 , Edited by admin on Sat Dec 16 19:16:58 GMT 2023
PRIMARY
EPA CompTox
DTXSID40277198
Created by admin on Sat Dec 16 19:16:58 GMT 2023 , Edited by admin on Sat Dec 16 19:16:58 GMT 2023
PRIMARY
FDA UNII
9K3E73SV3A
Created by admin on Sat Dec 16 19:16:58 GMT 2023 , Edited by admin on Sat Dec 16 19:16:58 GMT 2023
PRIMARY