Methyl 4-(4-chlorophenyl)-1,2,3,4-tetrahydro-2-oxo-6-(1H-1,2,4-triazol-1-ylmethyl)-5-pyrimidinecarboxylate

CAS Registry Number®

889951-14-8
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CAS Name

Methyl 4-(4-chlorophenyl)-1,2,3,4-tetrahydro-2-oxo-6-(1H-1,2,4-triazol-1-ylmethyl)-5-pyrimidinecarboxylate

Molecular Formula

C15H14ClN5O3

Molecular Mass

347.76

Cite this Page

Methyl 4-(4-chlorophenyl)-1,2,3,4-tetrahydro-2-oxo-6-(1H-1,2,4-triazol-1-ylmethyl)-5-pyrimidinecarboxylate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=889951-14-8 (retrieved 2024-09-16) (CAS RN: 889951-14-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C15H14ClN5O3/c1-24-14(22)12-11(6-21-8-17-7-18-21)19-15(23)20-13(12)9-2-4-10(16)5-3-9/h2-5,7-8,13H,6H2,1H3,(H2,19,20,23)

InChIKey

InChIKey=KTXFVEFFUFVGMQ-UHFFFAOYSA-N

SMILES

C(OC)(=O)C=1C(NC(=O)NC1CN2C=NC=N2)C3=CC=C(Cl)C=C3

Canonical SMILES

O=C(OC)C1=C(NC(=O)NC1C2=CC=C(Cl)C=C2)CN3N=CN=C3

Other Names for this Substance

  • 5-Pyrimidinecarboxylic acid, 4-(4-chlorophenyl)-1,2,3,4-tetrahydro-2-oxo-6-(1H-1,2,4-triazol-1-ylmethyl)-, methyl ester
  • Methyl 4-(4-chlorophenyl)-1,2,3,4-tetrahydro-2-oxo-6-(1H-1,2,4-triazol-1-ylmethyl)-5-pyrimidinecarboxylate