Ethyl 4-[[3-(4-chlorophenyl)-4,5-dihydro-4-(phenylmethyl)-5-thioxo-1H-1,2,4-triazol-1-yl]methyl]-1-piperazinecarboxylate

CAS Registry Number®

312523-57-2

CAS Name

Ethyl 4-[[3-(4-chlorophenyl)-4,5-dihydro-4-(phenylmethyl)-5-thioxo-1H-1,2,4-triazol-1-yl]methyl]-1-piperazinecarboxylate

Molecular Formula

C23H26ClN5O2S

Molecular Mass

472.00

Cite this Page

Ethyl 4-[[3-(4-chlorophenyl)-4,5-dihydro-4-(phenylmethyl)-5-thioxo-1H-1,2,4-triazol-1-yl]methyl]-1-piperazinecarboxylate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=312523-57-2 (retrieved 2024-12-23) (CAS RN: 312523-57-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C23H26ClN5O2S/c1-2-31-23(30)27-14-12-26(13-15-27)17-29-22(32)28(16-18-6-4-3-5-7-18)21(25-29)19-8-10-20(24)11-9-19/h3-11H,2,12-17H2,1H3

InChIKey

InChIKey=IJKNENKWBWWALG-UHFFFAOYSA-N

SMILES

C(N1C(=NN(CN2CCN(C(OCC)=O)CC2)C1=S)C3=CC=C(Cl)C=C3)C4=CC=CC=C4

Canonical SMILES

O=C(OCC)N1CCN(CN2N=C(C=3C=CC(Cl)=CC3)N(C2=S)CC=4C=CC=CC4)CC1

Other Names for this Substance

  • 1-Piperazinecarboxylic acid, 4-[[3-(4-chlorophenyl)-4,5-dihydro-4-(phenylmethyl)-5-thioxo-1H-1,2,4-triazol-1-yl]methyl]-, ethyl ester
  • Ethyl 4-[[3-(4-chlorophenyl)-4,5-dihydro-4-(phenylmethyl)-5-thioxo-1H-1,2,4-triazol-1-yl]methyl]-1-piperazinecarboxylate

CAS INSIGHTSTM
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