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tert-butyl [(2S)-1-[4-({(2S)-1-[(3,5-dimethoxyphenyl)amino]-3-methyl-1-oxobutan-2-yl}carbamoyl)piperidin-1-yl]-4-(methylsulfanyl)-1-oxobutan-2-yl]carbamate

Catalog ID
STL528734
SMILES CSCC[C@@H](C(=O)N1CCC(CC1)C(=O)N[C@H](C(=O)Nc1cc(OC)cc(c1)OC)C(C)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 C29H46N4O7S MW 594.77 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H46N4O7S/c1-18(2)24(26(35)30-20-15-21(38-6)17-22(16-20)39-7)32-25(34)19-9-12-33(13-10-19)27(36)23(11-14-41-8)31-28(37)40-29(3,4)5/h15-19,23-24H,9-14H2,1-8H3,(H,30,35)(H,31,37)(H,32,34)/t23-,24-/m0/s1
InChIKey
HCNLOAADDNMZDB-ZEQRLZLVSA-N
Synonyms
956813-67-5
~(tert)butyl~(N)((2~(S))1(4(((2~(S))1(35dimethoxyanilino)3methyl1oxobutan2yl)carbamoyl)piperidin1yl)4methylsulfanyl1oxobutan2yl)carbamate
16403718
956813675
CSCC(C@@H)(C(=O)N1CCC(CC1)C(=O)N(C@H)(C(=O)Nc1cc(OC)cc(c1)OC)C(C)C)NC(=O)OC(C)(C)C
InChI=1SC29H46N4O7Sc118(2)24(26(35)30201521(386)1722(1620)397)3225(34)1991233(131019)27(36)23(1114418)3128(37)4029(34)5h15192324H914H218H3(H3035)(H3137)(H3234)t2324m0s1
MFCD05729580
tertbutyl((2S)1(4(((2S)1((35dimethoxyphenyl)amino)3methyl1oxobutan2yl)carbamoyl)piperidin1yl)4(methylsulfanyl)1oxobutan2yl)carbamate
tertbutyl((S)1(4(((S)1((35dimethoxyphenyl)amino)3methyl1oxobutan2yl)carbamoyl)piperidin1yl)4(methylthio)1oxobutan2yl)carbamate
ZINC000070699270
ZINC70699270

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Available files

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

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