Vitas-M small molecule compound
tert-butyl {(2S)-1-[4-({(2S)-1-[(4-fluorophenyl)amino]-3-methyl-1-oxobutan-2-yl}carbamoyl)piperidin-1-yl]-4-methyl-1-oxopentan-2-yl}carbamate
Catalog ID
STL537860
SMILES CC(C[C@@H](C(=O)N1CCC(CC1)C(=O)N[C@H](C(=O)Nc1ccc(cc1)F)C(C)C)NC(=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 C28H43FN4O5 MW 534.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H43FN4O5/c1-17(2)16-22(31-27(37)38-28(5,6)7)26(36)33-14-12-19(13-15-33)24(34)32-23(18(3)4)25(35)30-21-10-8-20(29)9-11-21/h8-11,17-19,22-23H,12-16H2,1-7H3,(H,30,35)(H,31,37)(H,32,34)/t22-,23-/m0/s1InChIKey
ZJOIBGHGXFZMGW-GOTSBHOMSA-NSynonyms
956942-44-2~(tert)butyl~(N)((2~(S))1(4(((2~(S))1(4fluoroanilino)3methyl1oxobutan2yl)carbamoyl)piperidin1yl)4methyl1oxopentan2yl)carbamate
16399751
956942442
CC(C(C@@H)(C(=O)N1CCC(CC1)C(=O)N(C@H)(C(=O)Nc1ccc(cc1)F)C(C)C)NC(=O)OC(C)(C)C)C
InChI=1SC28H43FN4O5c117(2)1622(3127(37)3828(56)7)26(36)33141219(131533)24(34)3223(18(3)4)25(35)302110820(29)91121h81117192223H1216H217H3(H3035)(H3137)(H3234)t2223m0s1
tertbutyl((2S)1(4(((2S)1((4fluorophenyl)amino)3methyl1oxobutan2yl)carbamoyl)piperidin1yl)4methyl1oxopentan2yl)carbamate
tertbutyl((S)1(4(((S)1((4fluorophenyl)amino)3methyl1oxobutan2yl)carbamoyl)piperidin1yl)4methyl1oxopentan2yl)carbamate
ZINC000012860511
ZINC12860511
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.