Vitas-M small molecule compound

tert-butyl (2S)-2-{[4-({(2S)-1-[(2-methoxybenzyl)amino]-1-oxopropan-2-yl}carbamoyl)piperidin-1-yl]carbonyl}pyrrolidine-1-carboxylate

Catalog ID
STL540077
SMILES COc1ccccc1CNC(=O)[C@@H](NC(=O)C1CCN(CC1)C(=O)[C@@H]1CCCN1C(=O)OC(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 C27H40N4O6 MW 516.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H40N4O6/c1-18(23(32)28-17-20-9-6-7-11-22(20)36-5)29-24(33)19-12-15-30(16-13-19)25(34)21-10-8-14-31(21)26(35)37-27(2,3)4/h6-7,9,11,18-19,21H,8,10,12-17H2,1-5H3,(H,28,32)(H,29,33)/t18-,21-/m0/s1
InChIKey
FVIBWHVCUMNZLO-RXVVDRJESA-N
Synonyms
957047-71-1
(S)tertbutyl2(4(((S)1((2methoxybenzyl)amino)1oxopropan2yl)carbamoyl)piperidine1carbonyl)pyrrolidine1carboxylate
~(tert)butyl(2~(S))2(4(((2~(S))1((2methoxyphenyl)methylamino)1oxopropan2yl)carbamoyl)piperidine1carbonyl)pyrrolidine1carboxylate
16400352
957047711
COc1ccccc1CNC(=O)(C@@H)(NC(=O)C1CCN(CC1)C(=O)(C@@H)1CCCN1C(=O)OC(C)(C)C)C
InChI=1SC27H40N4O6c118(23(32)2817209671122(20)365)2924(33)19121530(161319)25(34)211081431(21)26(35)3727(23)4h67911181921H8101217H215H3(H2832)(H2933)t1821m0s1
tertbutyl(2S)2((4(((2S)1((2methoxybenzyl)amino)1oxopropan2yl)carbamoyl)piperidin1yl)carbonyl)pyrrolidine1carboxylate
ZINC000012864348

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Available files

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