Vitas-M small molecule compound
tert-butyl [(2S)-1-[4-({(2S)-1-[(4-ethylphenyl)amino]-3-methyl-1-oxobutan-2-yl}carbamoyl)piperidin-1-yl]-4-(methylsulfanyl)-1-oxobutan-2-yl]carbamate
Catalog ID
STL537877
SMILES CSCC[C@@H](C(=O)N1CCC(CC1)C(=O)N[C@H](C(=O)Nc1ccc(cc1)CC)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 C29H46N4O5S MW 562.77 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H46N4O5S/c1-8-20-9-11-22(12-10-20)30-26(35)24(19(2)3)32-25(34)21-13-16-33(17-14-21)27(36)23(15-18-39-7)31-28(37)38-29(4,5)6/h9-12,19,21,23-24H,8,13-18H2,1-7H3,(H,30,35)(H,31,37)(H,32,34)/t23-,24-/m0/s1InChIKey
CLWNNNUAPFCHQQ-ZEQRLZLVSA-NSynonyms
956944-25-5~(tert)butyl~(N)((2~(S))1(4(((2~(S))1(4ethylanilino)3methyl1oxobutan2yl)carbamoyl)piperidin1yl)4methylsulfanyl1oxobutan2yl)carbamate
16400653
956944255
CSCC(C@@H)(C(=O)N1CCC(CC1)C(=O)N(C@H)(C(=O)Nc1ccc(cc1)CC)C(C)C)NC(=O)OC(C)(C)C
InChI=1SC29H46N4O5Sc182091122(121020)3026(35)24(19(2)3)3225(34)21131633(171421)27(36)23(1518397)3128(37)3829(45)6h91219212324H81318H217H3(H3035)(H3137)(H3234)t2324m0s1
tertbutyl((2S)1(4(((2S)1((4ethylphenyl)amino)3methyl1oxobutan2yl)carbamoyl)piperidin1yl)4(methylsulfanyl)1oxobutan2yl)carbamate
tertbutyl((S)1(4(((S)1((4ethylphenyl)amino)3methyl1oxobutan2yl)carbamoyl)piperidin1yl)4(methylthio)1oxobutan2yl)carbamate
ZINC000070687628
ZINC70687628
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.