benthiavalicarb-isopropyl (Q27155585)

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chemical compound
  • 1-methylethyl ((1S)-1-((((1R)-1-(6-fluoro-2-benzothiazolyl)ethyl)amino)carbonyl)-2-methylpropyl)carbamate
  • isopropyl ((S)-1-{((1R)-1-(6-fluoro-1,3-benzothiazol-2-yl)ethyl)carbamoyl}-2-methylpropyl)carbamate
  • benthiavalicarb isopropyl
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Language Label Description Also known as
English
benthiavalicarb-isopropyl
chemical compound
  • 1-methylethyl ((1S)-1-((((1R)-1-(6-fluoro-2-benzothiazolyl)ethyl)amino)carbonyl)-2-methylpropyl)carbamate
  • isopropyl ((S)-1-{((1R)-1-(6-fluoro-1,3-benzothiazol-2-yl)ethyl)carbamoyl}-2-methylpropyl)carbamate
  • benthiavalicarb isopropyl

Statements

mass
381.152±0 dalton
1 reference
stated in
PubChem
PubChem CID
53297381
language of work or name
English
title
Benthiavalicarb isopropyl (English)
retrieved
18 November 2016
chemical formula
C₁₈H₂₄FN₃O₃S
1 reference
stated in
PubChem
PubChem CID
53297381
language of work or name
English
title
Benthiavalicarb isopropyl (English)
retrieved
18 November 2016
canonical SMILES
CC(C)C(C(=O)NC(C)C1=NC2=C(S1)C=C(C=C2)F)NC(=O)OC(C)C
1 reference
stated in
PubChem
PubChem CID
53297381
language of work or name
English
title
Benthiavalicarb isopropyl (English)
retrieved
18 November 2016
isomeric SMILES
C[C@H](C1=NC2=C(S1)C=C(C=C2)F)NC(=O)[C@H](C(C)C)NC(=O)OC(C)C
1 reference
stated in
PubChem
PubChem CID
53297381
language of work or name
English
title
Benthiavalicarb isopropyl (English)
retrieved
18 November 2016

Identifiers

ChemSpider ID
11677329
1 reference
stated in
ChemSpider
ChemSpider ID
11677329
language of work or name
English
title
benthiavalicarb-isopropyl (English)
retrieved
18 November 2016
Reaxys registry number
11343403
1 reference
stated in
ChEBI
ChEBI ID
81732
language of work or name
English
title
benthiavalicarb-isopropyl (English)
retrieved
9 October 2016
ChEMBL ID
CHEMBL2334743
1 reference
stated in
ChEMBL
ChEMBL ID
CHEMBL2334743
language of work or name
English
title
BENTHIAVALICARB-ISOPROPYL (English)
retrieved
18 November 2016
HSDB ID
7501
1 reference
stated in
Hazardous Substances Data Bank
HSDB ID
7501
publication date
28 October 2019
title
BENTHIAVALICARB ISOPROPYL (English)
retrieved
10 May 2021
EC number
605-799-5
1 reference
stated in
ECHA Substance Infocard database
ECHA Substance Infocard ID
100.111.723
retrieved
27 December 2018
title
Isopropyl [(S)-1-{[(R)-1-(6-fluoro-1,3-benzothiazol-2-yl)ethyl]carbamoyl}-2-methylpropyl]carbamate (English)
quotation
CAS no.: 177406-68-7 (English)
ECHA Substance Infocard ID
100.111.723
1 reference
stated in
ECHA Substance Infocard database
ECHA Substance Infocard ID
100.111.723
retrieved
27 December 2018
title
Isopropyl [(S)-1-{[(R)-1-(6-fluoro-1,3-benzothiazol-2-yl)ethyl]carbamoyl}-2-methylpropyl]carbamate (English)
quotation
CAS no.: 177406-68-7 (English)
KEGG ID
C18415
1 reference
stated in
ChEBI
ChEBI ID
81732
language of work or name
English
title
benthiavalicarb-isopropyl (English)
retrieved
9 October 2016
 
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