Vitas-M small molecule compound

tert-butyl {(2S)-1-[4-({(2S)-1-[(4-ethylphenyl)amino]-1-oxopropan-2-yl}carbamoyl)piperidin-1-yl]-3-methyl-1-oxobutan-2-yl}carbamate

Catalog ID
STL537401
SMILES CCc1ccc(cc1)NC(=O)[C@@H](NC(=O)C1CCN(CC1)C(=O)[C@H](C(C)C)NC(=O)OC(C)(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 C27H42N4O5 MW 502.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H42N4O5/c1-8-19-9-11-21(12-10-19)29-23(32)18(4)28-24(33)20-13-15-31(16-14-20)25(34)22(17(2)3)30-26(35)36-27(5,6)7/h9-12,17-18,20,22H,8,13-16H2,1-7H3,(H,28,33)(H,29,32)(H,30,35)/t18-,22-/m0/s1
InChIKey
UTEQQEITINVAPB-AVRDEDQJSA-N
Synonyms
956955-40-1
~(tert)butyl~(N)((2~(S))1(4(((2~(S))1(4ethylanilino)1oxopropan2yl)carbamoyl)piperidin1yl)3methyl1oxobutan2yl)carbamate
16400994
956955401
CCc1ccc(cc1)NC(=O)(C@@H)(NC(=O)C1CCN(CC1)C(=O)(C@H)(C(C)C)NC(=O)OC(C)(C)C)C
InChI=1SC27H42N4O5c181991121(121019)2923(32)18(4)2824(33)20131531(161420)25(34)22(17(2)3)3026(35)3627(56)7h91217182022H81316H217H3(H2833)(H2932)(H3035)t1822m0s1
tertbutyl((2S)1(4(((2S)1((4ethylphenyl)amino)1oxopropan2yl)carbamoyl)piperidin1yl)3methyl1oxobutan2yl)carbamate
tertbutyl((S)1(4(((S)1((4ethylphenyl)amino)1oxopropan2yl)carbamoyl)piperidin1yl)3methyl1oxobutan2yl)carbamate
ZINC000008918501
ZINC8918501

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Available files

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