Products 1398044-41-1

CAS 1398044-41-1 appears in our catalog under these names: Thiorphan Methoxyacetophenone-d5 Derivative, Thiorphan methoxyacetophenone-d5. Offered by: TRC, MedChemExpress. Available pack sizes: 100mg, 1mg, 5mg.

Structural formula: {0} (CAS {1})

2-[[2-[[2-(3-methoxyphenyl)-2-oxoethyl]sulfanylmethyl]-3-(2,3,4,5,6-pentadeuteriophenyl)propanoyl]amino]acetic acid (CAS 1398044-41-1) is a chemical compound with the molecular formula C21H23NO5S and a molecular weight of 406.5 g/mol. IUPAC name: 2-[[2-[[2-(3-methoxyphenyl)-2-oxoethyl]sulfanylmethyl]-3-(2,3,4,5,6-pentadeuteriophenyl)propanoyl]amino]acetic acid. InChIKey: LYFBMQMMAFLEHC-QRKCWBMQSA-N.

Identity
Molecular formulaC21H23NO5S
Molecular weight406.5 g/mol
IUPAC name2-[[2-[[2-(3-methoxyphenyl)-2-oxoethyl]sulfanylmethyl]-3-(2,3,4,5,6-pentadeuteriophenyl)propanoyl]amino]acetic acid
InChIKeyLYFBMQMMAFLEHC-QRKCWBMQSA-N
SMILES[2H]C1=C(C(=C(C(=C1[2H])[2H])CC(CSCC(=O)C2=CC(=CC=C2)OC)C(=O)NCC(=O)O)[2H])[2H]

Computed by PubChem (NCBI)