efavirenz (Q422645)

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chemical compound
  • (S)-6-chloro-4-(cyclopropylethynyl)-1,4-dihydro-4-(trifluoromethyl)-2H-3,1-benzoxazin-2-one
  • (-)-6-chloro-4-cyclopropylethynyl-4-trifluoromethyl-1,4-dihydro-2H-3,1-benzoxazin-2-one
  • (S)-6-chloro-4-cyclopropylethynyl-4-trifluoromethyl-1,4-dihydro-benzo[d][1,3]oxazin-2-one
  • 6-chloro-4-(2-cyclopropyl-1-ethynyl)-4-trifluoromethyl-(4S)-1,4-dihydro-2H-benzo[d][1,3]oxazin-2-one
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Language Label Description Also known as
English
efavirenz
chemical compound
  • (S)-6-chloro-4-(cyclopropylethynyl)-1,4-dihydro-4-(trifluoromethyl)-2H-3,1-benzoxazin-2-one
  • (-)-6-chloro-4-cyclopropylethynyl-4-trifluoromethyl-1,4-dihydro-2H-3,1-benzoxazin-2-one
  • (S)-6-chloro-4-cyclopropylethynyl-4-trifluoromethyl-1,4-dihydro-benzo[d][1,3]oxazin-2-one
  • 6-chloro-4-(2-cyclopropyl-1-ethynyl)-4-trifluoromethyl-(4S)-1,4-dihydro-2H-benzo[d][1,3]oxazin-2-one

Statements

chemical structure
Efavirenz skeletal.svg
450 × 505; 2 KB
0 references
mass
315.027 dalton
1 reference
stated in
PubChem
PubChem CID
64139
language of work or name
English
title
efavirenz (English)
retrieved
18 November 2016
chemical formula
C₁₄H₉ClF₃NO₂
1 reference
stated in
PubChem
PubChem CID
64139
language of work or name
English
title
efavirenz (English)
retrieved
18 November 2016
canonical SMILES
C1CC1C#CC2(C3=C(C=CC(=C3)Cl)NC(=O)O2)C(F)(F)F
1 reference
stated in
PubChem
PubChem CID
64139
language of work or name
English
title
efavirenz (English)
retrieved
18 November 2016
isomeric SMILES
C1CC1C#C[C@]2(C3=C(C=CC(=C3)Cl)NC(=O)O2)C(F)(F)F
1 reference
stated in
PubChem
PubChem CID
64139
language of work or name
English
title
efavirenz (English)
retrieved
18 November 2016
significant drug interaction
Commons category
Efavirenz
0 references

Identifiers

Reaxys registry number
7387333
1 reference
stated in
ChEBI
ChEBI ID
119486
language of work or name
English
title
efavirenz (English)
retrieved
19 October 2016
MassBank accession ID
SM851803
0 references
SM851853
0 references
MSBNK-Eawag-EQ329201
0 references
MSBNK-Eawag-EQ329202
0 references
MSBNK-Eawag-EQ329203
0 references
MSBNK-Eawag-EQ329204
0 references
MSBNK-Eawag-EQ329205
0 references
MSBNK-Eawag-EQ329206
0 references
MSBNK-Eawag-EQ329251
0 references
MSBNK-Eawag-EQ329252
0 references
MSBNK-Eawag-EQ329253
0 references
MSBNK-Eawag-EQ329254
0 references
MSBNK-Eawag-EQ329255
0 references
MSBNK-Eawag-EQ329256
0 references
MSBNK-Waters-WA000367
0 references
MSBNK-Waters-WA000368
0 references
MSBNK-Waters-WA000369
0 references
MSBNK-Waters-WA000370
0 references
MSBNK-Waters-WA000371
0 references
MSBNK-Waters-WA000372
0 references
MSBNK-Waters-WA000373
0 references
HSDB ID
7163
1 reference
stated in
Hazardous Substances Data Bank
HSDB ID
7163
publication date
28 October 2019
title
EFAVIRENZ (English)
retrieved
10 May 2021
LiverTox ID
Efavirenz
0 references
NSC number
742403
0 references
EC number
620-492-6
1 reference
stated in
ECHA Substance Infocard database
ECHA Substance Infocard ID
100.149.346
retrieved
27 December 2018
title
(4S)-6-Chloro-4-(2-cyclopropylethynyl)-1,4-dihydro-4-(trifluoromethyl)-2H-3,1-benzoxazin-2-one (English)
quotation
CAS no.: 154598-52-4 (English)
ECHA Substance Infocard ID
100.149.346
1 reference
stated in
ECHA Substance Infocard database
ECHA Substance Infocard ID
100.149.346
retrieved
27 December 2018
title
(4S)-6-Chloro-4-(2-cyclopropylethynyl)-1,4-dihydro-4-(trifluoromethyl)-2H-3,1-benzoxazin-2-one (English)
quotation
CAS no.: 154598-52-4 (English)
KEGG ID
D00896
1 reference
stated in
ChEBI
ChEBI ID
119486
language of work or name
English
title
efavirenz (English)
retrieved
19 October 2016
PDB ligand ID
EFZ
0 references
CAB ID
142007
1 reference
stated in
CAB Thesaurus
retrieved
6 April 2020
electronic Essential Medicines List medicine ID
450
1 reference
reference URL
https://list.essentialmeds.org/medicines/450
title
eEML - Electronic Essential Medicines List (English)
retrieved
23 October 2021
KBpedia ID
Efavirenz
1 reference
stated in
KBpedia
retrieved
9 July 2020
 
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