Vitas-M small molecule compound
N-[(2S)-1-{4-[(4-methoxyphenyl)sulfonyl]piperazin-1-yl}-3-methyl-1-oxobutan-2-yl]-1-[(4-methylphenyl)sulfonyl]piperidine-4-carboxamide
Catalog ID
STL042089
SMILES COc1ccc(cc1)S(=O)(=O)N1CCN(CC1)C(=O)[C@H](C(C)C)NC(=O)C1CCN(CC1)S(=O)(=O)c1ccc(cc1)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 C29H40N4O7S2 MW 620.79 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H40N4O7S2/c1-21(2)27(29(35)31-17-19-33(20-18-31)42(38,39)26-11-7-24(40-4)8-12-26)30-28(34)23-13-15-32(16-14-23)41(36,37)25-9-5-22(3)6-10-25/h5-12,21,23,27H,13-20H2,1-4H3,(H,30,34)/t27-/m0/s1InChIKey
CNCMPPOCHIOPDC-MHZLTWQESA-NSynonyms
(S)N(1(4((4methoxyphenyl)sulfonyl)piperazin1yl)3methyl1oxobutan2yl)1tosylpiperidine4carboxamide
CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC(C(C)C)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)OC
COc1ccc(cc1)S(=O)(=O)N1CCN(CC1)C(=O)(C@H)(C(C)C)NC(=O)C1CCN(CC1)S(=O)(=O)c1ccc(cc1)C
InChI=1SC29H40N4O7S2c121(2)27(29(35)31171933(201831)42(3839)2611724(404)81226)3028(34)23131532(161423)41(3637)259522(3)61025h512212327H1320H214H3(H3034)t27m0s1
MFCD05728921
N((2S)1(4((4methoxyphenyl)sulfonyl)piperazin1yl)3methyl1oxobutan2yl)1((4methylphenyl)sulfonyl)piperidine4carboxamide
N((2S)1(4(4methoxyphenyl)sulfonylpiperazin1yl)3methyl1oxobutan2yl)1(4methylphenyl)sulfonylpiperidine4carboxamide
ZINC000102869517
ZINC102869517
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.