Vitas-M small molecule compound

tert-butyl [(2S)-3-methyl-1-oxo-1-(4-{[(2S)-1-oxo-1-{[4-(propan-2-yl)phenyl]amino}propan-2-yl]carbamoyl}piperidin-1-yl)butan-2-yl]carbamate

Catalog ID
STL565886
SMILES O=C(OC(C)(C)C)N[C@H](C(=O)N1CCC(CC1)C(=O)N[C@H](C(=O)Nc1ccc(cc1)C(C)C)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 C28H44N4O5 MW 516.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H44N4O5/c1-17(2)20-9-11-22(12-10-20)30-24(33)19(5)29-25(34)21-13-15-32(16-14-21)26(35)23(18(3)4)31-27(36)37-28(6,7)8/h9-12,17-19,21,23H,13-16H2,1-8H3,(H,29,34)(H,30,33)(H,31,36)/t19-,23-/m0/s1
InChIKey
WIQBSWYODPUFQY-CVDCTZTESA-N
Synonyms
957024-48-5
16400585
957024485
InChI=1SC28H44N4O5c117(2)2091122(121020)3024(33)19(5)2925(34)21131532(161421)26(35)23(18(3)4)3127(36)3728(67)8h91217192123H1316H218H3(H2934)(H3033)(H3136)t1923m0s1
MFCD05671671
O=C(OC(C)(C)C)N(C@H)(C(=O)N1CCC(CC1)C(=O)N(C@H)(C(=O)Nc1ccc(cc1)C(C)C)C)C(C)C
tertbutyl((2S)3methyl1oxo1(4(((2S)1oxo1((4(propan2yl)phenyl)amino)propan2yl)carbamoyl)piperidin1yl)butan2yl)carbamate
tertbutyl((S)1(4(((S)1((4isopropylphenyl)amino)1oxopropan2yl)carbamoyl)piperidin1yl)3methyl1oxobutan2yl)carbamate
tertbutylN((2S)3methyl1oxo1(4(((2S)1oxo1(4propan2ylanilino)propan2yl)carbamoyl)piperidin1yl)butan2yl)carbamate
ZINC000012865203

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Available files

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