Vitas-M small molecule compound

(3S)-N-{(1R)-2-[(4-methoxybenzyl)amino]-2-oxo-1-phenylethyl}-1,2,3,4-tetrahydroisoquinoline-3-carboxamide

Catalog ID
STL531713
SMILES COc1ccc(cc1)CNC(=O)[C@@H](c1ccccc1)NC(=O)[C@H]1NCc2c(C1)cccc2

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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 C26H27N3O3 MW 429.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27N3O3/c1-32-22-13-11-18(12-14-22)16-28-26(31)24(19-7-3-2-4-8-19)29-25(30)23-15-20-9-5-6-10-21(20)17-27-23/h2-14,23-24,27H,15-17H2,1H3,(H,28,31)(H,29,30)/t23-,24+/m0/s1
InChIKey
PTFZJLBSFTZXSK-BJKOFHAPSA-N
Synonyms

(3~(S))~(N)((1~(R))2((4methoxyphenyl)methylamino)2oxo1phenylethyl)1234tetrahydroisoquinoline3carboxamide
(3S)N((1R)2((4methoxybenzyl)amino)2oxo1phenylethyl)1234tetrahydroisoquinoline3carboxamide
(S)N((R)2((4methoxybenzyl)amino)2oxo1phenylethyl)1234tetrahydroisoquinoline3carboxamidehydrochloride
16404831
COc1ccc(cc1)CNC(=O)(C@@H)(c1ccccc1)NC(=O)(C@H)1NCc2c(C1)cccc2Cl
InChI=1SC26H27N3O3c13222131118(121422)162826(31)24(197324819)2925(30)2315209561021(20)172723h214232427H1517H21H3(H2831)(H2930)t2324+m0s1
ZINC000035485245
ZINC35485245

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Available files

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