Vitas-M small molecule compound

methyl N-{[(4-methoxy-6-oxo-1,6-dihydropyrimidin-2-yl)sulfanyl]acetyl}leucinate

Catalog ID
STK785584
SMILES COC(=O)C(NC(=O)CSc1nc(OC)cc(=O)[nH]1)CC(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 C14H21N3O5S MW 343.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H21N3O5S/c1-8(2)5-9(13(20)22-4)15-11(19)7-23-14-16-10(18)6-12(17-14)21-3/h6,8-9H,5,7H2,1-4H3,(H,15,19)(H,16,17,18)
InChIKey
MEJKIOYWAQHZIL-UHFFFAOYSA-N
Synonyms

CC(C)CC(C(=O)OC)NC(=O)CSC1=NC(=CC(=O)N1)OC
COC(=O)C(NC(=O)CSc1nc(OC)cc(=O)(nH)1)CC(C)C
InChI=1SC14H21N3O5Sc18(2)59(13(20)224)1511(19)723141610(18)612(1714)213h689H57H214H3(H1519)(H161718)
METHYL2((2((4METHOXY6OXO1HPYRIMIDIN2YL)SULFANYL)ACETYL)AMINO)4METHYLPENTANOATE
methylN(((4methoxy6oxo16dihydropyrimidin2yl)sulfanyl)acetyl)leucinate
MFCD07800034
ZINC000004632344
ZINC000004632345

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Available files

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