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Vitas-M small molecule compound

tert-butyl {(2S)-1-[4-({(2S)-3-methyl-1-[(4-methylphenyl)amino]-1-oxobutan-2-yl}carbamoyl)piperidin-1-yl]-1-oxo-3-phenylpropan-2-yl}carbamate

Catalog ID
STL002687
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)Cc1ccccc1

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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 C32H44N4O5 MW 564.73 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H44N4O5/c1-21(2)27(29(38)33-25-14-12-22(3)13-15-25)35-28(37)24-16-18-36(19-17-24)30(39)26(20-23-10-8-7-9-11-23)34-31(40)41-32(4,5)6/h7-15,21,24,26-27H,16-20H2,1-6H3,(H,33,38)(H,34,40)(H,35,37)/t26-,27-/m0/s1
InChIKey
DBWZQJLQDUYMCX-SVBPBHIXSA-N
Synonyms
956816-82-3
956816823
CC1=CC=C(C=C1)NC(=O)C(C(C)C)NC(=O)C2CCN(CC2)C(=O)C(CC3=CC=CC=C3)NC(=O)OC(C)(C)C
InChI=1SC32H44N4O5c121(2)27(29(38)3325141222(3)131525)3528(37)24161836(191724)30(39)26(2023108791123)3431(40)4132(45)6h71521242627H1620H216H3(H3338)(H3440)(H3537)t2627m0s1
MFCD07201493
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)Cc1ccccc1
TERTBUTYL((2S)1(4(((2S)3METHYL1((4METHYLPHENYL)AMINO)1OXOBUTAN2YL)CARBAMOYL)PIPERIDIN1YL)1OXO3PHENYLPROPAN2YL)CARBAMATE
tertbutyl((S)1(4(((S)3methyl1oxo1(ptolylamino)butan2yl)carbamoyl)piperidin1yl)1oxo3phenylpropan2yl)carbamate
tertbutylN((2S)1(4(((2S)3methyl1(4methylanilino)1oxobutan2yl)carbamoyl)piperidin1yl)1oxo3phenylpropan2yl)carbamate
ZINC000070686844
ZINC70686844

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Available files

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