1H-1,2,4-Triazole-3-carboxamide, 5-[[(2-aminoacetyl)amino]methyl]-1-[4-chloro-2-(2-chlorobenzoyl)phenyl]-N,N-dimethyl-, hydrochloride (1:1)

CAS Registry Number®

85815-37-8

CAS Name

1H-1,2,4-Triazole-3-carboxamide, 5-[[(2-aminoacetyl)amino]methyl]-1-[4-chloro-2-(2-chlorobenzoyl)phenyl]-N,N-dimethyl-, hydrochloride (1:1)

Molecular Formula

C21H20Cl2N6O3.ClH

Cite this Page

1H-1,2,4-Triazole-3-carboxamide, 5-[[(2-aminoacetyl)amino]methyl]-1-[4-chloro-2-(2-chlorobenzoyl)phenyl]-N,N-dimethyl-, hydrochloride (1:1).   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=85815-37-8 (retrieved 2024-11-26) (CAS RN: 85815-37-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    107 °C

Source(s)

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

Other Names and Identifiers

InChI

InChI=1S/C21H20Cl2N6O3.ClH/c1-28(2)21(32)20-26-17(11-25-18(30)10-24)29(27-20)16-8-7-12(22)9-14(16)19(31)13-5-3-4-6-15(13)23;/h3-9H,10-11,24H2,1-2H3,(H,25,30);1H

InChIKey

InChIKey=KHINGHZNENOVFD-UHFFFAOYSA-N

SMILES

C(NC(CN)=O)C=1N(N=C(C(N(C)C)=O)N1)C2=C(C(=O)C3=C(Cl)C=CC=C3)C=C(Cl)C=C2.Cl

Canonical SMILES

Cl.O=C(C=1C=CC=CC1Cl)C2=CC(Cl)=CC=C2N3N=C(N=C3CNC(=O)CN)C(=O)N(C)C

Other Names for this Substance

  • 1H-1,2,4-Triazole-3-carboxamide, 5-[[(2-aminoacetyl)amino]methyl]-1-[4-chloro-2-(2-chlorobenzoyl)phenyl]-N,N-dimethyl-, hydrochloride (1:1)
  • 1H-1,2,4-Triazole-3-carboxamide, 5-[[(aminoacetyl)amino]methyl]-1-[4-chloro-2-(2-chlorobenzoyl)phenyl]-N,N-dimethyl-, monohydrochloride
  • 450191S

Deleted or Replaced CAS Registry Numbers

89233-59-0

CAS INSIGHTSTM
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