Vitas-M small molecule compound

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

Catalog ID
STL547564
SMILES C[C@@H](C(=O)N1CCC(CC1)C(=O)N[C@H](C(=O)O)CCC(=O)O)NS(=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 C21H29N3O8S MW 483.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H29N3O8S/c1-13-3-5-16(6-4-13)33(31,32)23-14(2)20(28)24-11-9-15(10-12-24)19(27)22-17(21(29)30)7-8-18(25)26/h3-6,14-15,17,23H,7-12H2,1-2H3,(H,22,27)(H,25,26)(H,29,30)/t14-,17-/m0/s1
InChIKey
CRTDTKPCZDBHQT-YOEHRIQHSA-N
Synonyms
956941-78-9
(2~(S))2((1((2~(S))2((4methylphenyl)sulfonylamino)propanoyl)piperidine4carbonyl)amino)pentanedioicacid
(S)2(1((S)2(4methylphenylsulfonamido)propanoyl)piperidine4carboxamido)pentanedioicacid
16400678
956941789
C(C@@H)(C(=O)N1CCC(CC1)C(=O)N(C@H)(C(=O)O)CCC(=O)O)NS(=O)(=O)c1ccc(cc1)C
InChI=1SC21H29N3O8Sc1133516(6413)33(3132)2314(2)20(28)2411915(101224)19(27)2217(21(29)30)7818(25)26h3614151723H712H212H3(H2227)(H2526)(H2930)t1417m0s1
N((1(N((4methylphenyl)sulfonyl)Lalanyl)piperidin4yl)carbonyl)Lglutamicacid
ZINC000012865613
ZINC12865613

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Available files

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