Vitas-M small molecule compound

(2S,3R)-3-methyl-2-((3R)-5-oxo-2,3,5,9b-tetrahydrothiazolo[2,3-a]isoindole-3-carboxamido)pentanoic acid

Catalog ID
STL529982
SMILES CCC([C@@H](C(=O)O)NC(=O)[C@@H]1CSC2N1C(=O)c1c2cccc1)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 C17H20N2O4S MW 348.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H20N2O4S/c1-3-9(2)13(17(22)23)18-14(20)12-8-24-16-11-7-5-4-6-10(11)15(21)19(12)16/h4-7,9,12-13,16H,3,8H2,1-2H3,(H,18,20)(H,22,23)/t9?,12-,13-,16?/m0/s1
InChIKey
BVFKRSWCZDTZRX-ZVNBTNPUSA-N
Synonyms
956967-44-5
(2~(S))3methyl2(((3~(R))5oxo39~(b)dihydro2~(H)(13)thiazolo(23a)isoindole3carbonyl)amino)pentanoicacid
(2S3R)3methyl2((3R)5oxo2359btetrahydrothiazolo(23a)isoindole3carboxamido)pentanoicacid
CCC((C@@H)(C(=O)O)NC(=O)(C@@H)1CSC2N1C(=O)c1c2cccc1)C
Registry IDs
MFCD06767619
ZINC000004085536
ZINC000012884553

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Available files

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