Vitas-M small molecule compound

(R)-2-((2S,3S)-2-(3-hydroxy-1,2-dihydroquinoxaline-1-carboxamido)-3-methylpentanamido)-4-(methylthio)butanoic acid

Catalog ID
STL530398
SMILES CSCC[C@H](C(=O)O)NC(=O)[C@H](C(CC)C)NC(=O)N1CC(=Nc2c1cccc2)O

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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 C20H28N4O5S MW 436.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H28N4O5S/c1-4-12(2)17(18(26)22-14(19(27)28)9-10-30-3)23-20(29)24-11-16(25)21-13-7-5-6-8-15(13)24/h5-8,12,14,17H,4,9-11H2,1-3H3,(H,21,25)(H,22,26)(H,23,29)(H,27,28)/t12?,14-,17+/m1/s1
InChIKey
PZDCDLRIQOKDII-CQMOFONCSA-N
Synonyms
956996-11-5
(2~(R))2(((2~(S))3methyl2((3oxo24dihydroquinoxaline1carbonyl)amino)pentanoyl)amino)4methylsulfanylbutanoicacid
16406474
956996115
MFCD07796718
ZINC000008876684
ZINC000012889854

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Available files

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