Vitas-M small molecule compound

Nalpha-({1-[N-(tert-butoxycarbonyl)-L-methionyl]piperidin-4-yl}carbonyl)-N-(4-methylphenyl)-L-phenylalaninamide

Catalog ID
STL528638
SMILES CSCC[C@@H](C(=O)N1CCC(CC1)C(=O)N[C@H](C(=O)Nc1ccc(cc1)C)Cc1ccccc1)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 C32H44N4O5S MW 596.79 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H44N4O5S/c1-22-11-13-25(14-12-22)33-29(38)27(21-23-9-7-6-8-10-23)34-28(37)24-15-18-36(19-16-24)30(39)26(17-20-42-5)35-31(40)41-32(2,3)4/h6-14,24,26-27H,15-21H2,1-5H3,(H,33,38)(H,34,37)(H,35,40)/t26-,27-/m0/s1
InChIKey
WFTOKLRBARWSBN-SVBPBHIXSA-N
Synonyms
956913-47-6
~(tert)butyl~(N)((2~(S))1(4(((2~(S))1(4methylanilino)1oxo3phenylpropan2yl)carbamoyl)piperidin1yl)4methylsulfanyl1oxobutan2yl)carbamate
16399200
956913476
CSCC(C@@H)(C(=O)N1CCC(CC1)C(=O)N(C@H)(C(=O)Nc1ccc(cc1)C)Cc1ccccc1)NC(=O)OC(C)(C)C
InChI=1SC32H44N4O5Sc122111325(141222)3329(38)27(212397681023)3428(37)24151836(191624)30(39)26(1720425)3531(40)4132(23)4h614242627H1521H215H3(H3338)(H3437)(H3540)t2627m0s1
Nalpha((1(N(tertbutoxycarbonyl)Lmethionyl)piperidin4yl)carbonyl)N(4methylphenyl)Lphenylalaninamide
tertbutyl((S)4(methylthio)1oxo1(4(((S)1oxo3phenyl1(ptolylamino)propan2yl)carbamoyl)piperidin1yl)butan2yl)carbamate
ZINC000070680891
ZINC70680891

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Available files

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