Pibutidine

CAS Registry Number®

103922-33-4
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CAS Name

Pibutidine

Molecular Formula

C19H24N4O3

Molecular Mass

356.42

Cite this Page

Pibutidine.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=103922-33-4 (retrieved 2024-05-06) (CAS RN: 103922-33-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    225-230 °C (decomp)

Source(s)

  • (1) Denotes property values from the ZIC/VINITI data file provided by InfoChem.

Other Names and Identifiers

InChI

InChI=1S/C19H24N4O3/c20-16-17(19(25)18(16)24)22-7-2-5-11-26-15-12-14(6-8-21-15)13-23-9-3-1-4-10-23/h2,5-6,8,12,22H,1,3-4,7,9-11,13,20H2/b5-2-

InChIKey

InChIKey=XMDYZASWLGWIPL-DJWKRKHSSA-N

SMILES

N(C/C=C\COC1=CC(CN2CCCCC2)=CC=N1)C3=C(N)C(=O)C3=O

Canonical SMILES

O=C1C(=O)C(NCC=CCOC2=NC=CC(=C2)CN3CCCCC3)=C1N

Other Names for this Substance

  • 3-Cyclobutene-1,2-dione, 3-amino-4-[[(2Z)-4-[[4-(1-piperidinylmethyl)-2-pyridinyl]oxy]-2-buten-1-yl]amino]-
  • 3-Cyclobutene-1,2-dione, 3-amino-4-[[4-[[4-(1-piperidinylmethyl)-2-pyridinyl]oxy]-2-butenyl]amino]-, (Z)-
  • 3-Cyclobutene-1,2-dione, 3-amino-4-[[(2Z)-4-[[4-(1-piperidinylmethyl)-2-pyridinyl]oxy]-2-butenyl]amino]-
  • 3-Amino-4-[[(2Z)-4-[[4-(1-piperidinylmethyl)-2-pyridinyl]oxy]-2-buten-1-yl]amino]-3-cyclobutene-1,2-dione
  • Pibutidine

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