Vitas-M small molecule compound
tert-butyl [(2S)-1-[(3S)-3-(methylcarbamoyl)-3,4-dihydroisoquinolin-2(1H)-yl]-3-(1-methyl-1H-indol-3-yl)-1-oxopropan-2-yl]carbamate
Catalog ID
STL549036
SMILES CNC(=O)[C@@H]1Cc2ccccc2CN1C(=O)[C@H](Cc1cn(c2c1cccc2)C)NC(=O)OC(C)(C)C
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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 C28H34N4O4 MW 490.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H34N4O4/c1-28(2,3)36-27(35)30-22(14-20-16-31(5)23-13-9-8-12-21(20)23)26(34)32-17-19-11-7-6-10-18(19)15-24(32)25(33)29-4/h6-13,16,22,24H,14-15,17H2,1-5H3,(H,29,33)(H,30,35)/t22-,24-/m0/s1InChIKey
QKKKHPKVIADWRE-UPVQGACJSA-NSynonyms
~(tert)butyl~(N)((2~(S))1((3~(S))3(methylcarbamoyl)34dihydro1~(H)isoquinolin2yl)3(1methylindol3yl)1oxopropan2yl)carbamate
121542020
CNC(=O)(C@@H)1Cc2ccccc2CN1C(=O)(C@H)(Cc1cn(c2c1cccc2)C)NC(=O)OC(C)(C)C
InChI=1SC28H34N4O4c128(23)3627(35)3022(14201631(5)2313981221(20)23)26(34)32171911761018(19)1524(32)25(33)294h613162224H141517H215H3(H2933)(H3035)t2224m0s1
tertbutyl((2S)1((3S)3(methylcarbamoyl)34dihydroisoquinolin2(1H)yl)3(1methyl1Hindol3yl)1oxopropan2yl)carbamate
tertbutyl((S)3(1methyl1Hindol3yl)1((S)3(methylcarbamoyl)34dihydroisoquinolin2(1H)yl)1oxopropan2yl)carbamate
ZINC000263586112
ZINC263586112
Check stock
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Check stock on Vitas-MAvailable files
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