Ethyl 5-amino-1-(3-bromophenyl)-4-cyano-1H-pyrazole-3-carboxylate

CAS Registry Number®

1150163-94-2
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CAS Name

Ethyl 5-amino-1-(3-bromophenyl)-4-cyano-1H-pyrazole-3-carboxylate

Molecular Formula

C13H11BrN4O2

Molecular Mass

335.16

Cite this Page

Ethyl 5-amino-1-(3-bromophenyl)-4-cyano-1H-pyrazole-3-carboxylate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1150163-94-2 (retrieved 2024-06-26) (CAS RN: 1150163-94-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C13H11BrN4O2/c1-2-20-13(19)11-10(7-15)12(16)18(17-11)9-5-3-4-8(14)6-9/h3-6H,2,16H2,1H3

InChIKey

InChIKey=SPNROCVJFAVRHA-UHFFFAOYSA-N

SMILES

NC=1N(N=C(C(OCC)=O)C1C#N)C2=CC(Br)=CC=C2

Canonical SMILES

N#CC=1C(=NN(C=2C=CC=C(Br)C2)C1N)C(=O)OCC

Other Names for this Substance

  • 1H-Pyrazole-3-carboxylic acid, 5-amino-1-(3-bromophenyl)-4-cyano-, ethyl ester
  • Ethyl 5-amino-1-(3-bromophenyl)-4-cyano-1H-pyrazole-3-carboxylate

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