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Details

Stereochemistry RACEMIC
Molecular Formula C12H13NS2
Molecular Weight 235.368
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of THIAMBUTENE

SMILES

CC(N)C=C(C1=CC=CS1)C2=CC=CS2

InChI

InChIKey=MPMSDAJIMMQXKO-UHFFFAOYSA-N
InChI=1S/C12H13NS2/c1-9(13)8-10(11-4-2-6-14-11)12-5-3-7-15-12/h2-9H,13H2,1H3

HIDE SMILES / InChI

Molecular Formula C12H13NS2
Molecular Weight 235.368
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 19:04:51 GMT 2023
Edited
by admin
on Sat Dec 16 19:04:51 GMT 2023
Record UNII
7U6X3BAX5U
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
THIAMBUTENE
Common Name English
ALLYLAMINE, 1-METHYL-3,3-DI-2-THIENYL-
Systematic Name English
4,4-DI-2-THIENYL-3-BUTEN-2-AMINE
Systematic Name English
3-BUTEN-2-AMINE, 4,4-DI-2-THIENYL-
Systematic Name English
THIOPHENE, 2,2'-(3-AMINO-1-BUTENYLIDENE)DI-
Systematic Name English
Code System Code Type Description
WIKIPEDIA
Thiambutenes
Created by admin on Sat Dec 16 19:04:51 GMT 2023 , Edited by admin on Sat Dec 16 19:04:51 GMT 2023
PRIMARY
PUBCHEM
57158500
Created by admin on Sat Dec 16 19:04:51 GMT 2023 , Edited by admin on Sat Dec 16 19:04:51 GMT 2023
PRIMARY PUBCHEM
CAS
857725-50-9
Created by admin on Sat Dec 16 19:04:51 GMT 2023 , Edited by admin on Sat Dec 16 19:04:51 GMT 2023
PRIMARY
FDA UNII
7U6X3BAX5U
Created by admin on Sat Dec 16 19:04:51 GMT 2023 , Edited by admin on Sat Dec 16 19:04:51 GMT 2023
PRIMARY
EPA CompTox
DTXSID501336736
Created by admin on Sat Dec 16 19:04:51 GMT 2023 , Edited by admin on Sat Dec 16 19:04:51 GMT 2023
PRIMARY
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