Vitas-M small molecule compound

(3S)-6,7-dimethoxy-N-methyl-2-[(2S)-3-methyl-2-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)butanoyl]-1,2,3,4-tetrahydroisoquinoline-3-carboxamide

Catalog ID
STL579201
SMILES CNC(=O)[C@@H]1Cc2cc(OC)c(cc2CN1C(=O)[C@@H](N1Cc2c(C1=O)cccc2)C(C)C)OC

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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 C26H31N3O5 MW 465.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H31N3O5/c1-15(2)23(29-13-16-8-6-7-9-19(16)25(29)31)26(32)28-14-18-12-22(34-5)21(33-4)11-17(18)10-20(28)24(30)27-3/h6-9,11-12,15,20,23H,10,13-14H2,1-5H3,(H,27,30)/t20-,23-/m0/s1
InChIKey
ZDCBRUQIIFXNQB-REWPJTCUSA-N
Synonyms

(3S)67dimethoxyNmethyl2((2S)3methyl2(1oxo13dihydro2Hisoindol2yl)butanoyl)1234tetrahydroisoquinoline3carboxamide
(S)67dimethoxyNmethyl2((S)3methyl2(1oxoisoindolin2yl)butanoyl)1234tetrahydroisoquinoline3carboxamide
CNC(=O)(C@@H)1Cc2cc(OC)c(cc2CN1C(=O)(C@@H)(N1Cc2c(C1=O)cccc2)C(C)C)OC
InChI=1SC26H31N3O5c115(2)23(291316867919(16)25(29)31)26(32)2814181222(345)21(334)1117(18)1020(28)24(30)273h691112152023H101314H215H3(H2730)t2023m0s1
MFCD33397544

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Available files

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