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nintedanib (Q15149723)

From Wikidata
chemical compound
  • BIBF-1120
  • BIBF1120
  • Ofev®
  • Vargatef®
  • BIBF 1120
  • methyl (3Z)-3-[(4-{methyl[(4-methylpiperazin-1-yl)acetyl]amino}anilino)(phenyl)methylidene]-2-oxo-2,3-dihydro-1H-indole-6-carboxylate
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Language Label Description Also known as
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    English
    nintedanib
    chemical compound
    • BIBF-1120
    • BIBF1120
    • Ofev®
    • Vargatef®
    • BIBF 1120
    • methyl (3Z)-3-[(4-{methyl[(4-methylpiperazin-1-yl)acetyl]amino}anilino)(phenyl)methylidene]-2-oxo-2,3-dihydro-1H-indole-6-carboxylate

    Statements

    has use
    medication
    0 references
    chemical structure
    Nintedanib.svg
    512 × 364; 29 KB
    0 references
    chemical formula
    C₃₁H₃₃N₅O₄
    1 reference
    stated in
    PubChem
    PubChem CID
    9809715
    language of work or name
    English
    title
    Nintedanib (English)
    retrieved
    19 November 2016
    canonical SMILES
    CN1CCN(CC1)CC(=O)N(C)C2=CC=C(C=C2)NC(=C3C4=C(C=C(C=C4)C(=O)OC)NC3=O)C5=CC=CC=C5
    1 reference
    stated in
    PubChem
    PubChem CID
    9809715
    language of work or name
    English
    title
    Nintedanib (English)
    retrieved
    19 November 2016
    isomeric SMILES
    CN1CCN(CC1)CC(=O)N(C)C2=CC=C(C=C2)N/C(=C\3/C4=C(C=C(C=C4)C(=O)OC)NC3=O)/C5=CC=CC=C5
    1 reference
    stated in
    PubChem
    PubChem CID
    9809715
    language of work or name
    English
    title
    Nintedanib (English)
    retrieved
    19 November 2016
    physically interacts with
    mass
    539.253 dalton
    1 reference
    stated in
    PubChem
    PubChem CID
    9809715
    language of work or name
    English
    title
    Nintedanib (English)
    retrieved
    19 October 2016
    Commons category
    Nintedanib
    0 references

    Identifiers

    Reaxys registry number
    12016593
    1 reference
    stated in
    ChEBI
    ChEBI ID
    85164
    language of work or name
    English
    title
    nintedanib (English)
    retrieved
    19 October 2016
    HSDB ID
    8339
    1 reference
    stated in
    Hazardous Substances Data Bank
    HSDB ID
    8339
    publication date
    28 October 2019
    title
    Nintedanib (English)
    retrieved
    10 May 2021
    LiverTox ID
    Nintedanib
    0 references
    EC number
    809-588-0
    1 reference
    stated in
    ECHA Substance Infocard database
    ECHA Substance Infocard ID
    100.237.441
    retrieved
    27 December 2018
    title
    methyl (3Z)-3-[[4-[methyl-[2-(4-methylpiperazin-1-yl)acetyl]amino]anilino]-phenylmethylidene]-2-oxo-1H-indole-6-carboxylate (English)
    quotation
    CAS no.: 656247-17-5 (English)
    ECHA Substance Infocard ID
    100.237.441
    1 reference
    stated in
    ECHA Substance Infocard database
    ECHA Substance Infocard ID
    100.237.441
    retrieved
    27 December 2018
    title
    methyl (3Z)-3-[[4-[methyl-[2-(4-methylpiperazin-1-yl)acetyl]amino]anilino]-phenylmethylidene]-2-oxo-1H-indole-6-carboxylate (English)
    quotation
    CAS no.: 656247-17-5 (English)
    ATC code
    L01XE31
    0 references
    KEGG ID
    D10481
    1 reference
    stated in
    ChEBI
    ChEBI ID
    85164
    language of work or name
    English
    title
    nintedanib (English)
    retrieved
    19 October 2016
    PDB ligand ID
    XIN
    0 references
    Freebase ID
    /m/0gmc15r
    0 references
     
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