Vitas-M small molecule compound

methyl N-(3,4-dihydroisoquinolin-2(1H)-ylcarbonyl)phenylalaninate

Catalog ID
STL350574
SMILES COC(=O)C(NC(=O)N1CCc2c(C1)cccc2)Cc1ccccc1

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C20H22N2O3 MW 338.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22N2O3/c1-25-19(23)18(13-15-7-3-2-4-8-15)21-20(24)22-12-11-16-9-5-6-10-17(16)14-22/h2-10,18H,11-14H2,1H3,(H,21,24)
InChIKey
UBIDUZCHLHIDKC-UHFFFAOYSA-N
Synonyms

(S)methyl3phenyl2(1234tetrahydroisoquinoline2carboxamido)propanoate
COC(=O)(C@@H)(NC(=O)N1CCc2c(C1)cccc2)Cc1ccccc1
COC(=O)C(CC1=CC=CC=C1)NC(=O)N2CCC3=CC=CC=C3C2
InChI=1SC20H22N2O3c12519(23)18(13157324815)2120(24)221211169561017(16)1422h21018H1114H21H3(H2124)
methyl2(34dihydro1Hisoquinoline2carbonylamino)3phenylpropanoate
methylN(34dihydroisoquinolin2(1H)ylcarbonyl)phenylalaninate
MFCD28032358
ZINC000008990555
ZINC000095471302

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.