Vitas-M small molecule compound

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

Catalog ID
STL549243
SMILES OC(=O)C[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 C20H27N3O8S MW 469.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H27N3O8S/c1-12-3-5-15(6-4-12)32(30,31)22-13(2)19(27)23-9-7-14(8-10-23)18(26)21-16(20(28)29)11-17(24)25/h3-6,13-14,16,22H,7-11H2,1-2H3,(H,21,26)(H,24,25)(H,28,29)/t13-,16-/m0/s1
InChIKey
MZYKLIGFSKECTH-BBRMVZONSA-N
Synonyms
956913-71-6
(2~(S))2((1((2~(S))2((4methylphenyl)sulfonylamino)propanoyl)piperidine4carbonyl)amino)butanedioicacid
(S)2(1((S)2(4methylphenylsulfonamido)propanoyl)piperidine4carboxamido)succinicacid
16400501
956913716
InChI=1SC20H27N3O8Sc1123515(6412)32(3031)2213(2)19(27)239714(81023)18(26)2116(20(28)29)1117(24)25h3613141622H711H212H3(H2126)(H2425)(H2829)t1316m0s1
N((1(N((4methylphenyl)sulfonyl)Lalanyl)piperidin4yl)carbonyl)Lasparticacid
OC(=O)C(C@@H)(C(=O)O)NC(=O)C1CCN(CC1)C(=O)(C@@H)(NS(=O)(=O)c1ccc(cc1)C)C
ZINC000008918256
ZINC8918256

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Available files

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