Methyl 4-[3-[[[(4-fluorophenyl)amino]thioxomethyl](phenylmethyl)amino]-2,5-dioxo-1-pyrrolidinyl]benzoate

CAS Registry Number®

355140-95-3
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CAS Name

Methyl 4-[3-[[[(4-fluorophenyl)amino]thioxomethyl](phenylmethyl)amino]-2,5-dioxo-1-pyrrolidinyl]benzoate

Molecular Formula

C26H22FN3O4S

Molecular Mass

491.53

Cite this Page

Methyl 4-[3-[[[(4-fluorophenyl)amino]thioxomethyl](phenylmethyl)amino]-2,5-dioxo-1-pyrrolidinyl]benzoate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=355140-95-3 (retrieved 2024-09-07) (CAS RN: 355140-95-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C26H22FN3O4S/c1-34-25(33)18-7-13-21(14-8-18)30-23(31)15-22(24(30)32)29(16-17-5-3-2-4-6-17)26(35)28-20-11-9-19(27)10-12-20/h2-14,22H,15-16H2,1H3,(H,28,35)

InChIKey

InChIKey=AEBTWGVYMIIKOR-UHFFFAOYSA-N

SMILES

N(CC1=CC=CC=C1)(C(NC2=CC=C(F)C=C2)=S)C3C(=O)N(C(=O)C3)C4=CC=C(C(OC)=O)C=C4

Canonical SMILES

O=C(OC)C1=CC=C(C=C1)N2C(=O)CC(C2=O)N(C(=S)NC3=CC=C(F)C=C3)CC=4C=CC=CC4

Other Names for this Substance

  • Benzoic acid, 4-[3-[[[(4-fluorophenyl)amino]thioxomethyl](phenylmethyl)amino]-2,5-dioxo-1-pyrrolidinyl]-, methyl ester
  • Methyl 4-[3-[[[(4-fluorophenyl)amino]thioxomethyl](phenylmethyl)amino]-2,5-dioxo-1-pyrrolidinyl]benzoate