Vitas-M small molecule compound

N-[(1-{N-[(4-methylphenyl)sulfonyl]-L-alanyl}piperidin-4-yl)carbonyl]-L-methionine

Catalog ID
STL009162
SMILES CSCC[C@@H](C(=O)O)NC(=O)C1CCN(CC1)C(=O)[C@@H](NS(=O)(=O)c1ccc(cc1)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 C21H31N3O6S2 MW 485.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H31N3O6S2/c1-14-4-6-17(7-5-14)32(29,30)23-15(2)20(26)24-11-8-16(9-12-24)19(25)22-18(21(27)28)10-13-31-3/h4-7,15-16,18,23H,8-13H2,1-3H3,(H,22,25)(H,27,28)/t15-,18-/m0/s1
InChIKey
DLMMKCPJSFAJJK-YJBOKZPZSA-N
Synonyms
1013819-56-1
(2S)2((1((2S)2((4methylphenyl)sulfonylamino)propanoyl)piperidine4carbonyl)amino)4methylsulfanylbutanoicacid
(S)2(1((S)2(4methylphenylsulfonamido)propanoyl)piperidine4carboxamido)4(methylthio)butanoicacid
1013819561
CC1=CC=C(C=C1)S(=O)(=O)NC(C)C(=O)N2CCC(CC2)C(=O)NC(CCSC)C(=O)O
CSCC(C@@H)(C(=O)O)NC(=O)C1CCN(CC1)C(=O)(C@@H)(NS(=O)(=O)c1ccc(cc1)C)C
InChI=1SC21H31N3O6S2c1144617(7514)32(2930)2315(2)20(26)2411816(91224)19(25)2218(21(27)28)1013313h4715161823H813H213H3(H2225)(H2728)t1518m0s1
MFCD04160190
N((1(N((4methylphenyl)sulfonyl)Lalanyl)piperidin4yl)carbonyl)Lmethionine
ZINC000009216302
ZINC9216302

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.