Vitas-M small molecule compound
tert-butyl [(2S)-1-[4-({(2S)-3-methyl-1-[(4-methylbenzyl)amino]-1-oxobutan-2-yl}carbamoyl)piperidin-1-yl]-4-(methylsulfanyl)-1-oxobutan-2-yl]carbamate
Catalog ID
STL565875
SMILES CSCC[C@@H](C(=O)N1CCC(CC1)C(=O)N[C@H](C(=O)NCc1ccc(cc1)C)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/c1-19(2)24(26(35)30-18-21-10-8-20(3)9-11-21)32-25(34)22-12-15-33(16-13-22)27(36)23(14-17-39-7)31-28(37)38-29(4,5)6/h8-11,19,22-24H,12-18H2,1-7H3,(H,30,35)(H,31,37)(H,32,34)/t23-,24-/m0/s1InChIKey
ZMTBRYUVCMFZBK-ZEQRLZLVSA-NSynonyms
1173671-32-31173671323
16399455
CSCC(C@@H)(C(=O)N1CCC(CC1)C(=O)N(C@H)(C(=O)NCc1ccc(cc1)C)C(C)C)NC(=O)OC(C)(C)C
InChI=1SC29H46N4O5Sc119(2)24(26(35)30182110820(3)91121)3225(34)22121533(161322)27(36)23(1417397)3128(37)3829(45)6h811192224H1218H217H3(H3035)(H3137)(H3234)t2324m0s1
MFCD04143794
tertbutyl((2S)1(4(((2S)3methyl1((4methylbenzyl)amino)1oxobutan2yl)carbamoyl)piperidin1yl)4(methylsulfanyl)1oxobutan2yl)carbamate
tertbutyl((S)1(4(((S)3methyl1((4methylbenzyl)amino)1oxobutan2yl)carbamoyl)piperidin1yl)4(methylthio)1oxobutan2yl)carbamate
tertbutylN((2S)1(4(((2S)3methyl1((4methylphenyl)methylamino)1oxobutan2yl)carbamoyl)piperidin1yl)4methylsulfanyl1oxobutan2yl)carbamate
ZINC000070686447
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.