Vitas-M small molecule compound

N-{[1-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperidin-4-yl]carbonyl}-L-methionine

Catalog ID
STK716531
SMILES CSCC[C@@H](C(=O)O)NC(=O)C1CCN(CC1)S(=O)(=O)c1cccc2c1nsn2

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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 C17H22N4O5S3 MW 458.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H22N4O5S3/c1-27-10-7-13(17(23)24)18-16(22)11-5-8-21(9-6-11)29(25,26)14-4-2-3-12-15(14)20-28-19-12/h2-4,11,13H,5-10H2,1H3,(H,18,22)(H,23,24)/t13-/m0/s1
InChIKey
WFCAODYMIJBZIQ-ZDUSSCGKSA-N
Synonyms
957029-97-9
(2S)2((1(213benzothiadiazol4ylsulfonyl)piperidine4carbonyl)amino)4methylsulfanylbutanoicacid
(S)2(1(benzo(c)(125)thiadiazol4ylsulfonyl)piperidine4carboxamido)4(methylthio)butanoicacid
957029979
CSCC(C@@H)(C(=O)O)NC(=O)C1CCN(CC1)S(=O)(=O)c1cccc2c1nsn2
CSCCC(C(=O)O)NC(=O)C1CCN(CC1)S(=O)(=O)C2=CC=CC3=NSN=C32
InChI=1SC17H22N4O5S3c12710713(17(23)24)1816(22)115821(9611)29(2526)144231215(14)20281912h241113H510H21H3(H1822)(H2324)t13m0s1
MFCD08747511
N((1(213benzothiadiazol4ylsulfonyl)piperidin4yl)carbonyl)Lmethionine
ZINC000009306170
ZINC9306170

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Available files

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