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Vitas-M small molecule compound

tert-butyl {(2S)-1-[4-({(2S)-1-[(4-ethylphenyl)amino]-1-oxopropan-2-yl}carbamoyl)piperidin-1-yl]-4-methyl-1-oxopentan-2-yl}carbamate

Catalog ID
STL002210
SMILES CCc1ccc(cc1)NC(=O)[C@@H](NC(=O)C1CCN(CC1)C(=O)[C@@H](NC(=O)OC(C)(C)C)CC(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/c1-8-20-9-11-22(12-10-20)30-24(33)19(4)29-25(34)21-13-15-32(16-14-21)26(35)23(17-18(2)3)31-27(36)37-28(5,6)7/h9-12,18-19,21,23H,8,13-17H2,1-7H3,(H,29,34)(H,30,33)(H,31,36)/t19-,23-/m0/s1
InChIKey
WFRDRZSNSPNXQQ-CVDCTZTESA-N
Synonyms
956912-96-2
956912962
CCC1=CC=C(C=C1)NC(=O)C(C)NC(=O)C2CCN(CC2)C(=O)C(CC(C)C)NC(=O)OC(C)(C)C
CCc1ccc(cc1)NC(=O)(C@@H)(NC(=O)C1CCN(CC1)C(=O)(C@@H)(NC(=O)OC(C)(C)C)CC(C)C)C
InChI=1SC28H44N4O5c182091122(121020)3024(33)19(4)2925(34)21131532(161421)26(35)23(1718(2)3)3127(36)3728(56)7h91218192123H81317H217H3(H2934)(H3033)(H3136)t1923m0s1
MFCD05670890
TERTBUTYL((2S)1(4(((2S)1((4ETHYLPHENYL)AMINO)1OXOPROPAN2YL)CARBAMOYL)PIPERIDIN1YL)4METHYL1OXOPENTAN2YL)CARBAMATE
tertbutyl((S)1(4(((S)1((4ethylphenyl)amino)1oxopropan2yl)carbamoyl)piperidin1yl)4methyl1oxopentan2yl)carbamate
tertbutylN((2S)1(4(((2S)1(4ethylanilino)1oxopropan2yl)carbamoyl)piperidin1yl)4methyl1oxopentan2yl)carbamate
ZINC000008918074
ZINC08918074
ZINC8918074

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Available files

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